SCHEMBL3134915

SCHEMBL3134915

O=C1c2ccc(Cl)cc2CC1Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.58
CYP19A1 P11511 4/20 0.56
HTR1A P08908 4/20 0.52
HTR2A P28223 4/20 0.52
HTR2C P28335 4/20 0.52
HTR7 P34969 4/20 0.52
DRD3 P35462 3/20 0.52
DRD2 P14416 2/20 0.52
HRH1 P35367 1/20 0.52
HTR2B P41595 1/20 0.52
ACHE P22303 4/20 0.49
SIGMAR1 Q99720 3/20 0.49
CYP26A1 O43174 2/20 0.49
DRD4 P21917 3/20 0.48
MAOB P27338 2/20 0.47
SLC6A4 P31645 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
SCHEMBL29620996 1.00 METAP1 (0.58) METAP1CYP19A1HTR1AHTR2AHTR2C
SCHEMBL10689573 0.82 METAP1 (0.58) METAP1CYP19A1ACHESIGMAR1CYP26A1
SCHEMBL10269432 0.82 METAP1 (0.59) METAP1CYP19A1ACHESIGMAR1CYP26A1
SCHEMBL3033688 0.81 CYP19A1 (0.77) METAP1CYP19A1HTR1AACHESIGMAR1
SCHEMBL27236975 0.80 METAP1 (0.62) METAP1CYP19A1HTR1AHTR2AHTR2C
SCHEMBL257977 0.79 CYP19A1 (0.52) CYP19A1ACHESIGMAR1CYP26A1MAOB
SCHEMBL5582351 0.79 CYP19A1 (0.77) METAP1CYP19A1ACHECYP26A1
SCHEMBL12030974 0.79 CYP19A1 (0.52) CYP19A1ACHESIGMAR1CYP26A1MAOB
SCHEMBL16142397 0.78 METAP1 (0.64) METAP1CYP19A1HTR1AHTR2AHTR2C
SCHEMBL17147681 0.78 ACHE (0.56) CYP19A1ACHEMAOB

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-1423359-B1 C2-DISUBSTITUTED INDANE-1-ONES AND THEIR DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS SANOFI AVENTIS DEUTSCHLAND (DE) 2010-07-14 EP disclosed
US-7081467-B2 C2-disubstituted indan-1-ones and their derivatives, processes for their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-07-25 US disclosed
EP-1423359-A1 C2-DISUBSTITUTED INDANE-1-ONES AND THEIR DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS Aventis Pharma Deutschland GmbH (DE) 2004-06-02 EP disclosed
US-20030153609-A1 C2-disubstituted indan-1-ones and their derivatives, processes for their preparation and their use as pharmaceuticals AVENTIS PHARMA DUTSCHLAN GMBH. 2003-08-14 US disclosed
WO-2003020697-A1 C2-DISUBSTITUTED INDANE-1-ONES AND THEIR DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-03-13 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-20030153609-A1 C2-disubstituted indan-1-ones and their derivatives, processes for their preparation and their use as pharmaceuticals GPR119, INSR, IRS1 METAP1 775/4885CYP19A1 98/4885HTR1A 1176/4885

“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.