SCHEMBL7044076

SCHEMBL7044076

Cc1ccc(CC=O)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CYP3A4 P08684 1/20 0.43
KDM4E B2RXH2 2/20 0.40
CCR2 P41597 1/20 0.39
MAPT P10636 3/20 0.39
AGTR1 P30556 3/20 0.39
GAA P10253 2/20 0.39
KDM1A O60341 1/20 0.39
HPGD P15428 4/20 0.37
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
CHRNA1 P02708 1/20 0.36
CHRNG P07510 1/20 0.36
CHRNB1 P11230 1/20 0.36
CHRNB2 P17787 1/20 0.36
SLC6A2 P23975 1/20 0.36
CHRNB4 P30926 1/20 0.36
SLC6A4 P31645 1/20 0.36

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
SCHEMBL3410728 0.83 MCL1 (0.40) ALDH1A1SMN1; SMN2MEN1POLBKMT2A
SCHEMBL8964683 0.82 ALDH1A1 (0.47) ALDH1A1NPSR1CYP3A4KDM4EMAPT
SCHEMBL2560484 0.80 ALDH1A1 (0.37) ALDH1A1CYP3A4MAPTGAAMEN1
SCHEMBL1780435 0.80 IDO1 (0.54) ALDH1A1SMN1; SMN2POLBKMT2A
SCHEMBL1755263 0.79 NPSR1 (0.41) ALDH1A1NPSR1CYP3A4KDM4ECCR2
SCHEMBL27689636 0.78 CYP3A4 (0.46) ALDH1A1NPSR1CYP3A4KDM4ECCR2
SCHEMBL12107538 0.78 CYP3A4 (0.54) ALDH1A1NPSR1CYP3A4KDM4ECCR2
SCHEMBL6589323 0.77 ALDH1A1 (0.40) ALDH1A1NPSR1CYP3A4KDM4ECCR2
SCHEMBL5990330 0.77 ADH1B (0.46) ALDH1A1NPSR1CYP3A4MAPTAGTR1
SCHEMBL30031076 0.76 CYP3A4 (0.48) ALDH1A1NPSR1CYP3A4KDM4ECCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192644-A1 PIPERIDINE-2,6-DIONES AS SMALL MOLECULE DEGRADERS OF HELIOS AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-22 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
EP-3166937-A1 ANTIPROLIFERATIVE COMPOUNDS AND METHODS OF USE THEREOF Celgene Corporation (US) 2017-05-17 EP disclosed
WO-2016007848-A1 ANTIPROLIFERATIVE COMPOUNDS AND METHODS OF USE THEREOF CELGENE CORPORATION (US) 2016-01-14 WO disclosed
EP-1296971-A2 2-FLUOROBENZENESULFONYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION Pharmacia Corporation (US) 2003-04-02 EP disclosed
WO-2001081332-A2 2-FLUOROBENZENESULFONYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2001-11-01 WO 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 (1 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-20230192644-A1 PIPERIDINE-2,6-DIONES AS SMALL MOLECULE DEGRADERS OF HELIOS AND METHODS OF USE IKZF2, IKZF1, NUTF2 ALDH1A1 1391/4885NPSR1 2100/4885CYP3A4 1214/4885

“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.