SCHEMBL6711769

SCHEMBL6711769

Cn1c(C(=O)Nc2ccc(Cl)cc2-c2nnn[nH]2)cc2ccc(NC(=O)c3ccc(OC(F)(F)F)cc3)cc21

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCGR P47871 4/20 0.41
ABL1 P00519 7/20 0.41
RXFP1 Q9HBX9 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
TRPV1 Q8NER1 3/20 0.39
GRM4 Q14833 1/20 0.39
THRB P10828 1/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6713924 0.92 GPR35 (0.41) GCGRABL1RXFP1NPC1RAB9A
SCHEMBL6710151 0.90 ROCK2 (0.40) GCGRABL1NPC1RAB9ATRPV1
SCHEMBL6709012 0.85 ABL1 (0.45) GCGRABL1RXFP1NPC1RAB9A
SCHEMBL6707646 0.84 RXFP1 (0.45) RXFP1NPC1RAB9AGRM4THRB
SCHEMBL6707804 0.83 MAPT (0.43) RXFP1GRM4TP53SMN1; SMN2
SCHEMBL6707706 0.82 GRM4 (0.44) RXFP1NPC1RAB9AGRM4SMN1; SMN2
SCHEMBL6708839 0.82 GRM4 (0.42) RXFP1NPC1RAB9AGRM4
SCHEMBL6708004 0.81 RXFP1 (0.41) RXFP1GRM4SMN1; SMN2
SCHEMBL6714240 0.80 RXFP1 (0.42) RXFP1GRM4TP53
SCHEMBL6710017 0.80 RXFP1 (0.45) RXFP1GRM4THRB

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-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 GCGR 2611/4885ABL1 344/4885RXFP1 3836/4885

“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.