SCHEMBL26675160

SCHEMBL26675160

CPOCC#Cc1ccc(Br)cc1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PYCR1 P32322 1/20 0.37
▸ KCNH2 Q12809 1/20 0.33
▸ ACACB O00763 1/20 0.33
▸ LMNA P02545 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
SCHEMBL4622686 0.78 KCNH2 (0.41) PYCR1KCNH2ACACBLMNA
SCHEMBL9209153 0.76 KCNH2 (0.41) PYCR1KCNH2ACACBLMNA
SCHEMBL4623625 0.70 HTT (0.37) PYCR1KCNH2LMNA
SCHEMBL508102 0.69 PYCR1 (0.41) PYCR1KCNH2ACACBLMNA
SCHEMBL9158372 0.68 GABRP (0.44) PYCR1KCNH2ACACB
SCHEMBL4621099 0.67 PYCR1 (0.40) PYCR1ACACBLMNA
SCHEMBL22122003 0.67 CYP2C19 (0.60) PYCR1ACACBLMNA
SCHEMBL13997198 0.67 PYCR1 (0.47) PYCR1ACACBLMNA
SCHEMBL797749 0.67 FFAR1 (0.40) PYCR1ACACBLMNA
SCHEMBL81530 0.67 MMP2 (0.47) PYCR1ACACBLMNA

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-20230339884-A1 Triazole N-Linked Carbamoyl Cyclohexyl Acids as LPA Antagonists BRISTOL MYERS SQUIBB CO (US) 2023-10-26 — — 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-20230339884-A1 Triazole N-Linked Carbamoyl Cyclohexyl Acids as LPA Antagonists LPAR3, LPAR1, LPAR2 PYCR1 4076/4885KCNH2 3436/4885ACACB 831/4885

“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.

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