SCHEMBL2861464

SCHEMBL2861464

O=C(O)C(=Cc1ccccc1)CC(=O)N1CC2CCCCC2C1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
RECQL P46063 1/20 0.40
HPGD P15428 5/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
HSD17B10 Q99714 1/20 0.37
PKM P14618 1/20 0.36
MAPK1 P28482 1/20 0.36
F2 P00734 1/20 0.36
OPRK1 P41145 1/20 0.36
LMNA P02545 1/20 0.36
MME P08473 2/20 0.36
MAPT P10636 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
SCHEMBL4454944 1.00 CYP3A4 (0.44) CYP3A4CYP2C9RECQLHPGDALDH1A1
SCHEMBL4454947 1.00 CYP3A4 (0.44) CYP3A4CYP2C9RECQLHPGDALDH1A1
SCHEMBL4456248 1.00 CYP3A4 (0.44) CYP3A4CYP2C9RECQLHPGDALDH1A1
SCHEMBL4456242 1.00 CYP3A4 (0.44) CYP3A4CYP2C9RECQLHPGDALDH1A1
SCHEMBL2861462 1.00 CYP3A4 (0.44) CYP3A4CYP2C9RECQLHPGDALDH1A1
SCHEMBL8170512 1.00 CYP3A4 (0.44) CYP3A4CYP2C9RECQLHPGDALDH1A1
SCHEMBL2861461 1.00 CYP3A4 (0.44) CYP3A4CYP2C9RECQLHPGDALDH1A1
SCHEMBL9048573 0.92 CYP3A4 (0.40) CYP3A4CYP2C9RECQLHPGDALDH1A1
SCHEMBL9048580 0.92 CYP3A4 (0.40) CYP3A4CYP2C9RECQLHPGDALDH1A1
SCHEMBL27745843 0.92 CYP3A4 (0.40) CYP3A4CYP2C9RECQLHPGDALDH1A1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101346352-B Asymmetric reduction method KISSEI PHARMACEUTICAL 2011-04-13 CN claimed
US-7847107-B2 producing (2S)-2-benzyl-3-(cis-hexahydro-2-isoindolinylcarbonyl)propionic acid by catalytic reduction of 2-benzylidene-3-(cis-hexahydro-2-isoindolinylcarbonyl)propionic acid in the presence of an asymmetric catalyst prepared from a pyrrolidinebisphosphine compound KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-12-07 US claimed
US-20090043110-A1 Asymmetric Reduction Method KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-02-12 US claimed
EP-1978016-A1 ASYMMETRIC REDUCTION METHOD Kissei Pharmaceutical Co., Ltd. (JP) 2008-10-08 EP claimed
EP-0507534-B1 Succinic acid compounds KISSEI PHARMACEUTICAL (JP) 1996-02-28 EP claimed
CN-101346352-B Asymmetric reduction method KISSEI PHARMACEUTICAL 2011-04-13 CN disclosed
US-7847107-B2 producing (2S)-2-benzyl-3-(cis-hexahydro-2-isoindolinylcarbonyl)propionic acid by catalytic reduction of 2-benzylidene-3-(cis-hexahydro-2-isoindolinylcarbonyl)propionic acid in the presence of an asymmetric catalyst prepared from a pyrrolidinebisphosphine compound KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-12-07 US disclosed
US-7847107-B2 producing (2S)-2-benzyl-3-(cis-hexahydro-2-isoindolinylcarbonyl)propionic acid by catalytic reduction of 2-benzylidene-3-(cis-hexahydro-2-isoindolinylcarbonyl)propionic acid in the presence of an asymmetric catalyst prepared from a pyrrolidinebisphosphine compound KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-12-07 US disclosed
EP-1931359-A4 COMBINATION THERAPY FOR CONTROLLED CARBOHYDRATE DIGESTION ELIXIR PHARMACEUTICALS INC (US) 2009-04-01 EP disclosed
US-20090043110-A1 Asymmetric Reduction Method KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-02-12 US disclosed
US-20090043110-A1 Asymmetric Reduction Method KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-02-12 US disclosed
CN-101346352-A Asymmetric reduction method KISSEI PHARMACEUTICAL (JP) 2009-01-14 CN disclosed
EP-1931359-A2 COMBINATION THERAPY FOR CONTROLLED CARBOHYDRATE DIGESTION Elixir Pharmaceuticals, Inc. (US) 2008-06-18 EP disclosed
WO-2007077818-A1 ASYMMETRIC REDUCTION METHOD KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-07-12 WO disclosed
JP-2007176824-A ASYMMETRIC REDUCTION METHOD KISSEI PHARMACEUT CO LTD 2007-07-12 JP disclosed
WO-2007033292-A2 COMBINATION THERAPY FOR CONTROLLED CARBOHYDRATE DIGESTION ELIXIR PHARMACEUTICALS, INC. (US) 2007-03-22 WO disclosed
US-6133454-A Method for preparing a substituted perhydroisoindole ADIR ET COMPAGNIE (FR) 2000-10-17 US disclosed
EP-0507534-B1 Succinic acid compounds KISSEI PHARMACEUTICAL (JP) 1996-02-28 EP disclosed
US-5202335-A Hypoglycemic, antidiabetic agents KISSEI PHARMACEUTICAL CO., LTD. (JP) 1993-04-13 US disclosed
EP-0507534-A1 Succinic acid compounds KISSEI PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP 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-20090043110-A1 Asymmetric Reduction Method PDXK, BCKDK, AKR1C3 CYP3A4 1374/4885CYP2C9 935/4885RECQL 3670/4885

“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.