SCHEMBL18648002

SCHEMBL18648002

CCC(C)(C)c1ccc(Cl)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CYP3A4 P08684 4/20 0.37
CYP3A5 P20815 3/20 0.37
TSHR P16473 2/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
HTT P42858 1/20 0.35
KCNH2 Q12809 3/20 0.35
CCR2 P41597 1/20 0.34
HSD11B1 P28845 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NR3C1 P04150 1/20 0.33
NR3C2 P08235 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19232083 0.85 HDAC3 (0.37) HDAC3HDAC1HDAC2HDAC6CYP3A4
SCHEMBL19464679 0.85 HDAC3 (0.39) HDAC3HDAC1HDAC2HDAC6CYP3A4
SCHEMBL17552743 0.80 RIPK1 (0.41) HDAC3HDAC1HDAC2HDAC6CYP3A4
SCHEMBL13763478 0.80 CYP3A4 (0.54) CYP3A4TSHRMAPK1TDP1HTT
SCHEMBL1690351 0.79 HDAC3 (0.42) HDAC3HDAC1HDAC2HDAC6CYP3A4
SCHEMBL1348538 0.79 KCNH2 (0.49) HDAC3HDAC1HDAC2HDAC6CYP3A4
SCHEMBL27111756 0.79 HDAC3 (0.36) HDAC3HDAC1HDAC2HDAC6CYP3A4
SCHEMBL24000930 0.78 MAPK1 (0.39) CYP3A4TSHRMAPK1TDP1HTR2A
SCHEMBL10193081 0.78 KIF11 (0.43) MAPK1HTTNPSR1
SCHEMBL24835714 0.78 CASR (0.39) CYP3A4TSHRMAPK1TDP1L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912711-B2 Heterocyclic compounds as triggering receptor expressed on myeloid cells 2 agonists and methods of use AMGEN INC. (US) 2024-02-27 US disclosed
US-20230295170-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE AMGEN INC. 2023-09-21 US disclosed
US-20230295169-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE AMGEN INC. 2023-09-21 US disclosed
US-20230278991-A1 GLP-1R AGONISTS AND USES THEREOF QILU REGOR THERAPEUTICS INC. (CN) 2023-09-07 US disclosed
US-20230002390-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE AMGEN INC. 2023-01-05 US disclosed
US-20220048915-A1 Nitrogen-containing Heterocyclic Compound and Composition Thereof, Preparation Method Therefor, and Application Thereof SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2022-02-17 US disclosed
US-10954221-B2 GLP-1R agonists and uses thereof QILU REGOR THERAPEUTICS INC. (CN) 2021-03-23 US disclosed
US-20200325121-A1 GLP-1R AGONISTS AND USES THEREOF QILU REGOR THERAPEUTICS INC. (CN) 2020-10-15 US disclosed
US-10399932-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-03 US disclosed
US-10399933-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-03 US disclosed
US-10167254-B2 IDO inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-01-01 US disclosed
US-20180079712-A1 INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER BRISTOL MYERS SQUIBB CO (US) 2018-03-22 US disclosed
US-20180072660-A1 INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER BRISTOL MYERS SQUIBB CO (US) 2018-03-15 US disclosed
US-9790169-B2 IDO inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-10-17 US disclosed
US-20170231999-A1 IDO INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-08-17 US disclosed
US-9598422-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2017-03-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10167254-B2 IDO inhibitors IDO1, IDO2, INMT HDAC3 181/4885HDAC1 67/4885HDAC2 97/4885
US-20230002390-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE MSR1, FPR2, CD14 HDAC3 4321/4885HDAC1 4468/4885HDAC2 3246/4885
US-20170231999-A1 IDO INHIBITORS IDO1, IDO2, INMT HDAC3 181/4885HDAC1 67/4885HDAC2 97/4885
US-10954221-B2 GLP-1R agonists and uses thereof GLP1R, GPR119, GIPR HDAC3 2529/4885HDAC1 2913/4885HDAC2 2911/4885
US-10399932-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer IDO1, IDO2, INMT HDAC3 236/4885HDAC1 75/4885HDAC2 57/4885
US-11912711-B2 Heterocyclic compounds as triggering receptor expressed on myeloid cells 2 agonists and methods of use MSR1, FPR2, CD14 HDAC3 4321/4885HDAC1 4468/4885HDAC2 3246/4885
US-20230278991-A1 GLP-1R AGONISTS AND USES THEREOF GLP1R, GPR119, GIPR HDAC3 2529/4885HDAC1 2913/4885HDAC2 2911/4885
US-20220048915-A1 Nitrogen-containing Heterocyclic Compound and Composition Thereof, Preparation Method Therefor, and Application Thereof MAPK11, WEE1, NOS1 HDAC3 2967/4885HDAC1 878/4885HDAC2 1794/4885
US-20230295169-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE MSR1, FPR2, CD14 HDAC3 4321/4885HDAC1 4468/4885HDAC2 3246/4885
US-20230295170-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE MSR1, FPR2, CD14 HDAC3 4321/4885HDAC1 4468/4885HDAC2 3246/4885
US-20200325121-A1 GLP-1R AGONISTS AND USES THEREOF GLP1R, GPR119, GIPR HDAC3 2529/4885HDAC1 2913/4885HDAC2 2911/4885
US-20180072660-A1 INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER IDO1, IDO2, INMT HDAC3 236/4885HDAC1 75/4885HDAC2 57/4885
US-10399933-B2 Inhibitors of indoleamine-2,3-dioxygenase for the treatment of cancer IDO1, IDO2, INMT HDAC3 236/4885HDAC1 75/4885HDAC2 57/4885
US-20180079712-A1 INHIBITORS OF INDOLEAMINE-2,3-DIOXYGENASE FOR THE TREATMENT OF CANCER IDO1, IDO2, INMT HDAC3 236/4885HDAC1 75/4885HDAC2 57/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.