SCHEMBL2465375

SCHEMBL2465375

O=C(Nc1ccc(CCl)cc1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.62
KMT2A Q03164 2/20 0.52
FABP7 O15540 2/20 0.43
FABP5 Q01469 2/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
MAOB P27338 1/20 0.43
CASP3 P42574 2/20 0.42
ITGB3 P05106 1/20 0.41
ITGAV P06756 1/20 0.41
MDM4 O15151 1/20 0.40
TP53 P04637 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
SCHEMBL2465503 0.88 EPHX2 (0.63) EPHX2KMT2AFABP7FABP5BCHE
SCHEMBL15160758 0.87 EPHX2 (0.62) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL31607197 0.87 EPHX2 (0.65) EPHX2KMT2AFABP7FABP5MAOB
SCHEMBL23212115 0.87 EPHX2 (0.65) EPHX2KMT2AFABP7FABP5MAOB
SCHEMBL9632825 0.86 EPHX2 (0.64) EPHX2KMT2AFABP7FABP5
SCHEMBL16420440 0.86 EPHX2 (0.61) EPHX2KMT2AFABP7FABP5BCHE
SCHEMBL8366872 0.86 EPHX2 (0.75) EPHX2KMT2AFABP7FABP5BCHE
SCHEMBL29679600 0.86 EPHX2 (0.60) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL30567065 0.86 EPHX2 (0.60) EPHX2KMT2AFABP7FABP5CASP3
SCHEMBL1001375 0.86 EPHX2 (0.60) EPHX2KMT2AFABP7FABP5CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101212973-B 4-phenyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline derivatives as medicaments for the treatment of infertility ORGANON NV 2011-11-16 CN disclosed
US-8022218-B2 Hypogonadism; N-{3-[2-Bromo-4-(3-cyano-2-methyl-5-oxo-7-propyl-1,4,5,6,7,8-hexahydro-quinolin-4-yl)-6-ethoxy-phenoxymethyl]-phenyl}-3,4,5-trimethoxy-benzamide; low molecular weight hormone mimetics; selective Follicle Stimulating Hormone receptor agonists N.V. ORGANON (NL) 2011-09-20 US disclosed
US-20080275042-A1 4-Phenyl-5-Oxo-1,4,5,6,7,8-Hexahydroquinoline Derivatives for the Treatment of Infertility N.V. ORGANON (NL) 2008-11-06 US disclosed
EP-1881830-B1 4-PHENYL-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE DERIVATIVES THE TREATMENT OF INFERTILITY ORGANON NV (NL) 2008-10-08 EP disclosed
CN-101212973-A 4-phenyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline derivatives as medicaments for the treatment of infertility ORGANON NV (NL) 2008-07-02 CN disclosed
EP-1881830-A1 4-PHENYL-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE DERIVATIVES THE TREATMENT OF INFERTILITY N.V. Organon (NL) 2008-01-30 EP disclosed
WO-2006117368-A1 4-PHENYL-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE DERIVATIVES THE TREATMENT OF INFERTILITY N.V. ORGANON (NL) 2006-11-09 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-20080275042-A1 4-Phenyl-5-Oxo-1,4,5,6,7,8-Hexahydroquinoline Derivatives for the Treatment of Infertility CATSPER1, ABCB11, ACR EPHX2 3048/4885KMT2A 1161/4885FABP7 4240/4885

“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.