SCHEMBL5100353

SCHEMBL5100353

Cc1cc(C(=O)NC(Cc2ccc(O)cc2)c2nc3ccc(Cl)cc3[nH]2)ccc1C(=O)N1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HTT P42858 2/20 0.43
OPRM1 P35372 1/20 0.43
OPRD1 P41143 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
MAPT P10636 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
ALDH1A1 P00352 3/20 0.41
HRH4 Q9H3N8 2/20 0.41
ALOX12 P18054 1/20 0.41
APOBEC3A P31941 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
CYP51A1 Q16850 1/20 0.40
ACACB O00763 1/20 0.40
MAPK1 P28482 1/20 0.40
PIN1 Q13526 1/20 0.39

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
SCHEMBL5100455 0.94 MEN1 (0.43) MEN1KMT2AHTTOPRM1OPRD1
SCHEMBL5097255 0.90 MEN1 (0.45) MEN1KMT2AHTTOPRM1OPRD1
SCHEMBL14277106 0.89 HRH4 (0.45) MEN1KMT2AHTTOPRM1OPRD1
SCHEMBL5096865 0.87 KMT2A (0.43) MEN1KMT2AHTTOPRM1OPRD1
SCHEMBL5103816 0.87 HTT (0.51) MEN1KMT2AHTTOPRM1OPRD1
SCHEMBL14177384 0.86 HRH4 (0.43) MEN1KMT2AOPRM1OPRD1CTDSP1
SCHEMBL5100741 0.86 MEN1 (0.43) MEN1KMT2AHTTOPRM1OPRD1
SCHEMBL14277163 0.86 KMT2A (0.42) MEN1KMT2AHTTOPRM1OPRD1
SCHEMBL5100733 0.86 MEN1 (0.43) MEN1KMT2AHTTOPRM1OPRD1
SCHEMBL5104555 0.86 KMT2A (0.42) MEN1KMT2AHTTOPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080132496-A1 CARBOXYLIC ACID AMIDES, THE PREPARATION THEREOF, AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2008-06-05 US disclosed
US-7326791-B2 Carboxylic acid amides, the preparation thereof, and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO., KG (DE) 2008-02-05 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-20080132496-A1 CARBOXYLIC ACID AMIDES, THE PREPARATION THEREOF, AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS F12, F11, F2 MEN1 1667/4885KMT2A 3087/4885HTT 2895/4885

“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.