SCHEMBL23697124

SCHEMBL23697124

C=CCCc1ccnc(Cl)n1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
FFAR1 O14842 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
SCHEMBL595527 0.81 ALDH1A1 (0.34) ALDH1A1L3MBTL1
SCHEMBL27413913 0.79 KDM4E (0.35) FFAR1
SCHEMBL2018150 0.75 RECQL (0.35) FFAR1
SCHEMBL2013407 0.75 FFAR1 (0.32) FFAR1
SCHEMBL27621059 0.75 FFAR1 (0.32) FFAR1
SCHEMBL4263566 0.75 HRH1 (0.45) FFAR1
SCHEMBL24258919 0.74 KCNH2 (0.32) FFAR1
SCHEMBL22800177 0.73 KDM4E (0.34) ALDH1A1L3MBTL1
SCHEMBL16178953 0.72 KCNH2 (0.46)
SCHEMBL22800874 0.71 ALDH1A1 (0.38) ALDH1A1L3MBTL1

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-20210230143-A1 CYCLOHEXYL ACID TRIAZOLE AZINES AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2021-07-29 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-20210230143-A1 CYCLOHEXYL ACID TRIAZOLE AZINES AS LPA ANTAGONISTS LPAR3, LPAR1, LPAR2 ALDH1A1 2244/4885L3MBTL1 4166/4885FFAR1 11/4885

“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.