SCHEMBL1481671

SCHEMBL1481671

O=C(O)c1cn(Cc2ccc(-c3ccc(F)nc3)cn2)c2c(F)cccc2c1=O

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 7/20 0.62
DHODH Q02127 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.38
HIF1A Q16665 1/20 0.38
TOP1 P11387 3/20 0.37
MAPT P10636 1/20 0.35

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
SCHEMBL2488196 0.90 CHRM1 (0.78) CHRM1DHODHLMNATOP1
SCHEMBL1482024 0.85 CHRM1 (0.59) CHRM1KDM4ELMNATSHRHIF1A
SCHEMBL2485615 0.81 CHRM1 (0.77) CHRM1LMNATOP1
SCHEMBL2487130 0.80 CHRM1 (0.71) CHRM1LMNATOP1
SCHEMBL2489566 0.79 CHRM1 (0.73) CHRM1LMNATOP1MAPT
SCHEMBL1482877 0.78 CHRM1 (0.63) CHRM1KDM4ELMNATSHRHIF1A
SCHEMBL2488387 0.78 CHRM1 (0.71) CHRM1TOP1
SCHEMBL1482313 0.78 CHRM1 (0.57) CHRM1KDM4ELMNATSHRHIF1A
SCHEMBL3230348 0.78 CHRM1 (0.72) CHRM1LMNAMAPT
SCHEMBL2490145 0.77 CHRM1 (0.59) CHRM1DHODHTOP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293914-B2 4-OXO,1-4-dihydroquinoline M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2012-10-23 US claimed
US-8293914-B2 4-OXO,1-4-dihydroquinoline M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2012-10-23 US disclosed
US-8293914-B2 4-OXO,1-4-dihydroquinoline M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2012-10-23 US disclosed
US-8293914-B2 4-OXO,1-4-dihydroquinoline M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2012-10-23 US disclosed
US-20110077220-A1 4-OXO,1-4-DIHYDROQUINOLINE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP. 2011-03-31 US disclosed
US-20110077220-A1 4-OXO,1-4-DIHYDROQUINOLINE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP. 2011-03-31 US disclosed
US-20110077220-A1 4-OXO,1-4-DIHYDROQUINOLINE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME CORP. 2011-03-31 US disclosed
WO-2009134668-A2 4-OXO-1,4-DIHYDROQUINOLINE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK & CO., INC. (US) 2009-11-05 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-20110077220-A1 4-OXO,1-4-DIHYDROQUINOLINE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS CHRM1, OPRM1, OPRL1 CHRM1 1/4885DHODH 1597/4885KDM4E 935/4885

“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.