SCHEMBL3732088

SCHEMBL3732088

O=C(O)C1(c2ccccc2)NCCc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC9 Q9UKV0 1/20 0.43
AKR1C1 Q04828 1/20 0.40
KIF11 P52732 1/20 0.39
EDNRB P24530 1/20 0.38
EDNRA P25101 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
RECQL P46063 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP3A4 P08684 1/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
CASP1 P29466 1/20 0.38
BLM P54132 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 3/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL27956103 1.00 HDAC9 (0.43) HDAC9AKR1C1KIF11EDNRBEDNRA
SCHEMBL1404156 0.88 HDAC9 (0.41) HDAC9AKR1C1KIF11EDNRBEDNRA
SCHEMBL30685517 0.88 HDAC9 (0.41) HDAC9AKR1C1KIF11EDNRBEDNRA
SCHEMBL1404157 0.88 HDAC9 (0.41) HDAC9AKR1C1KIF11EDNRBEDNRA
SCHEMBL1404158 0.88 HDAC9 (0.41) HDAC9AKR1C1KIF11EDNRBEDNRA
SCHEMBL30685518 0.81 HDAC9 (0.36) HDAC9KIF11EDNRBEDNRAMEN1
SCHEMBL28389144 0.81 OPRM1 (0.50) EDNRBEDNRA
SCHEMBL22159666 0.81 HDAC9 (0.36) HDAC9KIF11EDNRBEDNRAMEN1
SCHEMBL27956109 0.81 OPRM1 (0.50) EDNRBEDNRA
SCHEMBL15568975 0.80 HDAC9 (0.34) HDAC9KIF11EDNRBEDNRAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1757604-B1 PROCESS FOR PRODUCING SOLIFENACIN OR ITS SALT ASTELLAS PHARMA INC (JP) 2012-05-30 EP disclosed
US-7829715-B2 Method for producing solifenacin or salts thereof ASTELLAS PHARMA INC. (JP) 2010-11-09 US disclosed
US-20070185329-A1 Method for producing solifenacin or salts thereof ASTELLAS PHARMA INC. 2007-08-09 US disclosed
EP-1757604-A1 PROCESS FOR PRODUCING SOLIFENACIN OR ITS SALT Astellas Pharma Inc. (JP) 2007-02-28 EP disclosed
WO-2005105795-A1 PROCESS FOR PRODUCING SOLIFENACIN OR ITS SALT ASTELLAS PHARMA INC. (JP) 2005-11-10 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-20070185329-A1 Method for producing solifenacin or salts thereof SUCNR1, GLS, CACNA1S HDAC9 1889/4885AKR1C1 929/4885KIF11 4103/4885

“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.