SCHEMBL24848504

SCHEMBL24848504

CC(C)NC(=O)NC1(C#N)CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSL P07711 12/20 0.43
CTSS P25774 6/20 0.39
CTSK P43235 6/20 0.39
CTSB P07858 5/20 0.39
CTSC P53634 2/20 0.38
RXFP1 Q9HBX9 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ATM Q13315 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
SCHEMBL22455228 0.78 CTSC (0.41) CTSLCTSSCTSKCTSBCTSC
SCHEMBL13401138 0.76 CTSL (0.49) CTSLCTSSCTSKCTSBCTSC
SCHEMBL14944319 0.74 CTSL (0.48) CTSLCTSSCTSKCTSBCTSC
SCHEMBL13684412 0.74 MEN1 (0.57) RXFP1KDM4EATM
SCHEMBL21413355 0.73 RXFP1 (0.45) CTSLCTSSCTSKCTSBCTSC
SCHEMBL13435738 0.73
SCHEMBL19116799 0.72 CTSL (0.46) CTSLCTSSCTSKCTSB
SCHEMBL17034775 0.71 EPHX2 (0.37)
SCHEMBL11568932 0.70 MEN1 (0.38) CTSLCTSSCTSKCTSBRXFP1
SCHEMBL11562969 0.70 CTSL (0.36) CTSLCTSSCTSKCTSBCTSC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002364-A1 BENZOTHIOPHENE DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-01-05 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 (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-20230002364-A1 BENZOTHIOPHENE DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF GPER1, GABRQ, GPR39 CTSL 4362/4885CTSS 4494/4885CTSK 4724/4885

“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.