SCHEMBL5951906

SCHEMBL5951906

CCC1Cc2cccc(-c3ccccc3)c2C1=O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.44
HTR7 P34969 4/20 0.43
HTR1A P08908 3/20 0.43
DRD2 P14416 2/20 0.43
ACHE P22303 5/20 0.40
CYP19A1 P11511 1/20 0.38

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
SCHEMBL5953020 0.88 METAP1 (0.42) METAP1HTR7HTR1ADRD2ACHE
SCHEMBL5951443 0.88 METAP1 (0.39) METAP1ACHECYP19A1
SCHEMBL5951441 0.86 ACHE (0.45) METAP1HTR7HTR1ADRD2ACHE
SCHEMBL5953291 0.85 CREBBP (0.42) METAP1DRD2ACHECYP19A1
SCHEMBL8165742 0.85 BRD4 (0.36) METAP1HTR7HTR1ADRD2ACHE
SCHEMBL5951450 0.84 METAP1 (0.41) METAP1HTR7HTR1ADRD2ACHE
SCHEMBL5953322 0.81 HTR7 (0.43) METAP1HTR7HTR1AACHECYP19A1
SCHEMBL5951356 0.80 GABRG2 (0.45) METAP1ACHECYP19A1
SCHEMBL5509273 0.80 ACHE (0.61) HTR7HTR1ADRD2ACHE
SCHEMBL866816 0.79 METAP1 (0.67) METAP1HTR7HTR1ADRD2ACHE

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
US-7038070-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2006-05-02 US disclosed
US-6963017-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2005-11-08 US disclosed
EP-0968158-B1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM BASELL POLYOLEFINE GMBH (DE) 2005-08-10 EP disclosed
US-20050033076-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2005-02-10 US disclosed
US-20030009046-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2003-01-09 US disclosed
EP-0968158-A1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM Basell Polyolefine GmbH (DE) 2000-01-05 EP disclosed
WO-1998040331-A1 PREPARATION OF PREPARING SUBSTITUTED INDANONES TARGOR GMBH (DE) 1998-09-17 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 (2 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-20050033076-A1 Preparation of preparing substituted indanones CYP1A2, CYP2J2, IDH3A METAP1 4201/4885HTR7 1861/4885HTR1A 2570/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 METAP1 4035/4885HTR7 2049/4885HTR1A 2132/4885

“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.