SCHEMBL1346356

SCHEMBL1346356

COC(=O)Cc1ccc2c(c1)C(=O)CCO2

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
GFER P55789 1/20 0.43
MAOB P27338 5/20 0.43
GRM5 P41594 2/20 0.42
MAOA P21397 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
GPR119 Q8TDV5 1/20 0.41
HTR1A P08908 7/20 0.41
SLC6A4 P31645 7/20 0.41
CYP2D6 P10635 1/20 0.41
MET P08581 1/20 0.40

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
SCHEMBL10732018 0.92 ALDH1A1 (0.42) ALDH1A1GAAGFERMAOBSMN1; SMN2
SCHEMBL10593445 0.89 GRM5 (0.54) ALDH1A1GAAGFERMAOBGRM5
SCHEMBL20766367 0.86 KMT2A (0.47) ALDH1A1GAAGFERSMN1; SMN2CYP4F2
SCHEMBL30523629 0.86 KMT2A (0.47) ALDH1A1GAAGFERSMN1; SMN2CYP4F2
SCHEMBL20381152 0.84 PDE3B (0.43) MAOBSMN1; SMN2HTR1ASLC6A4CYP2D6
SCHEMBL1162435 0.83 MAOB (0.46) ALDH1A1MAOBGRM5MAOASMN1; SMN2
SCHEMBL4521074 0.82 RAB9A (0.52) ALDH1A1GAAGFERSMN1; SMN2CYP4F2
SCHEMBL10732172 0.82 GRM5 (0.46) ALDH1A1GAAGFERMAOBGRM5
SCHEMBL19926744 0.80 SMN1; SMN2 (0.57) ALDH1A1GAAGFERSMN1; SMN2
SCHEMBL26087589 0.79 CHRM2 (0.48) ALDH1A1GAAGFERSMN1; SMN2CYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8778970-B2 Benzyl piperidine compound DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-07-15 US disclosed
US-20130303786-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO (JP) 2013-11-14 US disclosed
US-8557998-B2 Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2013-10-15 US disclosed
CN-101939297-B Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO 2012-10-17 CN disclosed
US-20120259122-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-10-11 US disclosed
US-8232405-B2 Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-07-31 US disclosed
EP-2463286-A1 BENZYL PIPERIDINE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-06-13 EP disclosed
CN-102482263-A Benzyl piperidine compounds DAINIPPON SUMITOMO PHARMA CO 2012-05-30 CN disclosed
US-20120130077-A1 BENZYL PIPERIDINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-24 US disclosed
US-8063223-B2 Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-11-22 US disclosed
US-8063223-B2 Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-11-22 US disclosed
US-8063223-B2 Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-11-22 US disclosed
US-20110118312-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-05-19 US disclosed
WO-2011016468-A1 BENZYL PIPERIDINE COMPOUND 大日本住友製薬株式会社 (JP) 2011-02-10 WO disclosed
CN-101939297-A Benzylpiperizine compound DAINIPPON SUMITOMO PHARMA CO 2011-01-05 CN disclosed
US-20100113792-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-05-06 US disclosed
US-20100113792-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-05-06 US disclosed
US-20100113792-A1 BENZYLPIPERIZINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-05-06 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 (5 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-20120130077-A1 BENZYL PIPERIDINE COMPOUND HTR1D, HTR1A, HTR1B ALDH1A1 1160/4885GAA 4779/4885GFER 4138/4885
US-20130303786-A1 BENZYLPIPERIZINE COMPOUND OPRM1, GRM1, CHRM1 ALDH1A1 1260/4885GAA 4693/4885GFER 4572/4885
US-20100113792-A1 BENZYLPIPERIZINE COMPOUND OPRM1, GRM1, CHRM1 ALDH1A1 1260/4885GAA 4693/4885GFER 4572/4885
US-20120259122-A1 BENZYLPIPERIZINE COMPOUND OPRM1, GRM1, CHRM1 ALDH1A1 1260/4885GAA 4693/4885GFER 4572/4885
US-20110118312-A1 BENZYLPIPERIZINE COMPOUND OPRM1, GRM1, CHRM1 ALDH1A1 1260/4885GAA 4693/4885GFER 4572/4885

“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.