SCHEMBL2134284

SCHEMBL2134284

COc1ccc(C(C)NC(=O)c2cccc(Oc3ccccc3)c2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
MEN1 O00255 1/20 0.53
CASP3 P42574 1/20 0.53
KMT2A Q03164 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
GPR139 Q6DWJ6 6/20 0.52
PGR P06401 1/20 0.50
S1PR3 Q99500 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
TAS1R3 Q7RTX0 1/20 0.48
TAS1R1 Q7RTX1 1/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
CACNA1I Q9P0X4 1/20 0.47
AR P10275 1/20 0.46
GCK P35557 1/20 0.46

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
SCHEMBL2134275 1.00 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1LMNAMEN1CASP3
SCHEMBL2139884 0.87 GPR132 (0.53) SMN1; SMN2ALDH1A1LMNA
SCHEMBL2139888 0.87 GPR132 (0.53) SMN1; SMN2ALDH1A1LMNA
SCHEMBL2141144 0.86 CACNA1I (0.54) SMN1; SMN2ALDH1A1LMNAMEN1CASP3
SCHEMBL2137267 0.86 CACNA1I (0.54) SMN1; SMN2ALDH1A1LMNAMEN1CASP3
SCHEMBL2137259 0.86 CACNA1I (0.54) SMN1; SMN2ALDH1A1LMNAMEN1CASP3
SCHEMBL2137046 0.80 CACNA1I (0.52) SMN1; SMN2ALDH1A1LMNAMEN1CASP3
SCHEMBL2137040 0.80 CACNA1I (0.52) SMN1; SMN2ALDH1A1LMNAMEN1CASP3
SCHEMBL21921152 0.78 GCK (0.45) SMN1; SMN2ALDH1A1LMNAMEN1CASP3
SCHEMBL8248607 0.78 ALDH1A1 (0.72) SMN1; SMN2ALDH1A1LMNAGPR139HDAC8

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-20120101105-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 US claimed
WO-2010137351-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC. (JP) 2010-12-02 WO claimed
EP-3632899-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RaQualia Pharma Inc. (JP) 2020-04-08 EP disclosed
US-9522140-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2016-12-20 US disclosed
US-20150322052-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC (JP) 2015-11-12 US disclosed
US-9101616-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2015-08-11 US disclosed
US-20120101105-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 US disclosed
WO-2010137351-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC. (JP) 2010-12-02 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 (2 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-20120101105-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS CACNA1I, CACNA1G, CACNA1H SMN1; SMN2 700/4885ALDH1A1 2895/4885LMNA 1268/4885
US-20150322052-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS CACNA1I, CACNA1G, CACNA1H SMN1; SMN2 708/4885ALDH1A1 2882/4885LMNA 1264/4885

“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.