SCHEMBL1482397

SCHEMBL1482397

CCOC(=O)c1cn(Cc2ccc(Br)cn2)c2c(F)ccc(F)c2c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.45
LMNA P02545 1/20 0.44
HTT P42858 2/20 0.43
STAT3 P40763 1/20 0.41
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
P2RX7 Q99572 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
JMJD6 Q6NYC1 1/20 0.36
P2RX3 P56373 1/20 0.36
TSHR P16473 1/20 0.35
CASP1 P29466 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
SCHEMBL1481951 0.87 LMNA (0.48) CHRM1LMNASTAT3KDM4EALDH1A1
SCHEMBL1126700 0.83 CHRM1 (0.42) CHRM1HTTSTAT3KDM4EALDH1A1
SCHEMBL1482039 0.83 CHRM1 (0.41) CHRM1LMNAHTTSTAT3KDM4E
SCHEMBL2492043 0.82 LMNA (0.51) CHRM1LMNAHTTSTAT3KDM4E
SCHEMBL6691224 0.80 TDP1 (0.55) CHRM1LMNAHTTSTAT3KDM4E
SCHEMBL3234568 0.78 CHRM1 (0.51) CHRM1LMNAHTTSTAT3KDM4E
SCHEMBL11894891 0.78 LMNA (0.56) CHRM1LMNAKDM4EALDH1A1TDP1
SCHEMBL14747226 0.76 CHRM1 (0.50) CHRM1LMNAHTTSTAT3KDM4E
SCHEMBL16378027 0.76 CHRM1 (0.76) CHRM1HTTSTAT3KDM4EALDH1A1
SCHEMBL1931751 0.76 CHRM1 (0.60) CHRM1HTTSTAT3KDM4EALDH1A1

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 6 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 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

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 1/4885LMNA 4479/4885HTT 872/4885

“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.