SCHEMBL5952375

SCHEMBL5952375

CCCC1Cc2c(Cl)cccc2C1=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 3/20 0.41
CYP19A1 P11511 2/20 0.40
ACHE P22303 3/20 0.38
AADAT Q8N5Z0 1/20 0.37
NOTUM Q6P988 1/20 0.36
HTR1A P08908 2/20 0.36
HTR7 P34969 2/20 0.36
DRD1 P21728 1/20 0.34
DRD3 P35462 1/20 0.34
HSP90AB1 P08238 1/20 0.34
GRM2 Q14416 1/20 0.34
KIF11 P52732 1/20 0.34
NSD2 O96028 1/20 0.33

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
SCHEMBL5953103 0.91 ACHE (0.39) METAP1CYP19A1ACHEAADATNOTUM
SCHEMBL5952774 0.87 METAP1 (0.43) METAP1CYP19A1ACHEAADATNOTUM
SCHEMBL5951985 0.84 CYP19A1 (0.43) METAP1CYP19A1ACHE
SCHEMBL5952561 0.83 CYP19A1 (0.41) METAP1CYP19A1ACHEAADATNOTUM
SCHEMBL1582584 0.81 METAP1 (0.41) METAP1CYP19A1ACHEHTR1AHTR7
SCHEMBL5951367 0.80 HTR1A (0.42) METAP1CYP19A1ACHEHTR1AHTR7
SCHEMBL5951525 0.80 METAP1 (0.40) METAP1CYP19A1ACHEAADATNOTUM
SCHEMBL5951697 0.78 SIRT2 (0.41) METAP1HTR1AHTR7DRD3HSP90AB1
SCHEMBL8596147 0.78 METAP1 (0.41) METAP1CYP19A1ACHEAADATNOTUM
SCHEMBL8874155 0.78 METAP1 (0.41) METAP1CYP19A1ACHEAADATNOTUM

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
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

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 4201/4885CYP19A1 18/4885ACHE 839/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 METAP1 4035/4885CYP19A1 17/4885ACHE 820/4885

“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.