SCHEMBL26077977

SCHEMBL26077977

Cn1ccnc1S(C)(C)S

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPO P22079 1/20 0.43
FDPS P14324 2/20 0.34
MCL1 Q07820 1/20 0.33
C1S P09871 1/20 0.33
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL569909 0.77 LPO (0.43) LPOFDPSMCL1C1SKMT2A
SCHEMBL5610390 0.71 LPO (0.41) LPOFDPSMCL1C1SKMT2A
SCHEMBL604082 0.71 LPO (0.41) LPOFDPSMCL1C1SKMT2A
SCHEMBL9033147 0.71 LPO (0.41) LPOFDPSMCL1C1SKMT2A
SCHEMBL5610393 0.71 LPO (0.41) LPOFDPSMCL1C1SHTT
SCHEMBL20368151 0.70 HTT (0.41) LPOFDPSMCL1C1SKMT2A
Hydrochloric Acid SCHEMBL28316626 0.70 LPO (0.40) LPOFDPSMCL1C1SKMT2A
Hydrochloric Acid SCHEMBL4002547 0.69 TSHR (0.37) LPOFDPSMCL1C1SHTT
SCHEMBL24051973 0.68 MCL1 (0.46) LPOFDPSMCL1C1SKMT2A
SCHEMBL22951445 0.68 MCL1 (0.40) LPOFDPSMCL1C1SKMT2A

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-20230303570-A1 KINASE INHIBITORS AND USES THEREOF ABM THERAPEUTICS CORP (US) 2023-09-28 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 (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-20230303570-A1 KINASE INHIBITORS AND USES THEREOF ERBB2, ERBB3, ERBB4 LPO 4870/4885FDPS 2675/4885MCL1 784/4885

“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.