SCHEMBL30296489

SCHEMBL30296489

COC(=O)c1cncc(-c2cc(F)c(N)cc2Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.50
ATM Q13315 1/20 0.44
CYP11B2 P19099 5/20 0.43
CYP11B1 P15538 3/20 0.43
ALPL P05186 1/20 0.40
PDGFRB P09619 6/20 0.39
KDR P35968 6/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
S1PR1 P21453 1/20 0.38
CFTR P13569 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL31026729 0.78 CYP11B1 (0.46) CYP11B2CYP11B1
SCHEMBL13079401 0.77 CYP2A6 (0.52) CYP2A6ATMCYP11B2CYP11B1ALPL
SCHEMBL30296491 0.75 CYP11B2 (0.43) CYP11B2CYP11B1
SCHEMBL26469046 0.75 CYP11B2 (0.43) CYP11B2CYP11B1
SCHEMBL30296246 0.74 CYP11B2 (0.41) CYP11B2CYP11B1
SCHEMBL3715051 0.74 ATM (0.69) CYP2A6ATMCYP11B2CYP11B1S1PR1
SCHEMBL31049800 0.73 CYP11B2 (0.55) CYP2A6ATMCYP11B2CYP11B1S1PR1
SCHEMBL30296309 0.70 CYP11B2 (0.42) CYP11B2CYP11B1
SCHEMBL4432846 0.70 CYP11B1 (0.63) CYP2A6ATMCYP11B2CYP11B1S1PR1
SCHEMBL3715166 0.70 EGFR (0.53) CYP2A6ATMCYP11B2CYP11B1PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240368173-A1 TRICYCLIC GPR65 MODULATORS Pathios Therapeutics Limited (GB) 2024-11-07 US disclosed
EP-4419203-A1 TRICYCLIC GPR65 MODULATORS Pathios Therapeutics Limited (GB) 2024-08-28 EP disclosed
WO-2023067322-A1 TRICYCLIC GPR65 MODULATORS Pathios Therapeutics Limited (GB) 2023-04-27 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-20240368173-A1 TRICYCLIC GPR65 MODULATORS GPR65, GPR3, NR1H2 CYP2A6 396/4885ATM 4161/4885CYP11B2 328/4885

“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.