SCHEMBL24364795

SCHEMBL24364795

C[C@H]1CC[C@H](c2ccc(CO)cc2)NC1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.33
CHEK1 O14757 1/20 0.32
CYP19A1 P11511 1/20 0.32
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
S1PR2 O95136 1/20 0.31
S1PR4 O95977 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
S1PR5 Q9H228 1/20 0.31
KDM1A O60341 1/20 0.31
EP300 Q09472 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL25322649 0.82 HRH3 (0.41) CHEK1ALDH1A1
SCHEMBL24364303 0.81 ESR2 (0.53) ESR2KDM1AALDH1A1
SCHEMBL31145247 0.81 ESR2 (0.53) ESR2KDM1AALDH1A1
SCHEMBL29324808 0.81 ESR2 (0.53) ESR2KDM1AALDH1A1
SCHEMBL24364796 0.81 KCNH2 (0.32) ESR2
SCHEMBL14963942 0.79 MAPT (0.39) ESR2HTR2AHTR2CHTR2BKDM1A
SCHEMBL25321512 0.79 MAPT (0.39) ESR2HTR2AHTR2CHTR2BKDM1A
SCHEMBL24233794 0.79 MAPT (0.39) ESR2HTR2AHTR2CHTR2BKDM1A
SCHEMBL24363974 0.77 KCNH2 (0.37) ESR2KDM1A
SCHEMBL24233839 0.77 DRD2 (0.36) ESR2CYP19A1DDB1CRBNALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 US disclosed
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 US disclosed
EP-4188920-A1 PIPERIDIN-1-YL-N-PYRYDINE-3-YL-2-OXOACETAMIDE DERIVATIVES USEFUL FOR THE TREATMENT OF MTAP-DEFICIENT AND/OR MTA-ACCUMULATING CANCERS Tango Therapeutics, Inc. (US) 2023-06-07 EP disclosed
US-20220127256-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2022-04-28 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 (2 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-20220127256-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 ESR2 935/4885CHEK1 4336/4885CYP19A1 187/4885
US-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 ESR2 935/4885CHEK1 4336/4885CYP19A1 187/4885

“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.