SCHEMBL5952548

SCHEMBL5952548

CC(=O)c1ccc(-c2cccc3c2C(=O)C(C)C3)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.47
MAPT P10636 2/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
MAOB P27338 3/20 0.38
MAOA P21397 2/20 0.38
DRD2 P14416 2/20 0.38
CREBBP Q92793 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ABCB1 P08183 1/20 0.37
PRKDC P78527 1/20 0.37
HSD17B1 P14061 2/20 0.37
STAT3 P40763 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
SCHEMBL5952393 0.89 ACHE (0.47) ACHEHPGDMAOBMAOADRD2
SCHEMBL5952261 0.85 ACHE (0.44) ACHEMAPTHPGDMAOBMAOA
SCHEMBL5952849 0.85 EGFR (0.45) ACHEMAPTHPGDSMN1; SMN2
SCHEMBL5951497 0.84 ACHE (0.51) ACHEMAOBMAOADRD2ABCB1
SCHEMBL5952527 0.82 ACHE (0.57) ACHEMAOBMAOADRD2CREBBP
SCHEMBL5951841 0.82 ACHE (0.53) ACHEMAOBMAOADRD2NPC1
SCHEMBL5509273 0.82 ACHE (0.61) ACHEMAOBMAOADRD2CREBBP
SCHEMBL5952093 0.81 ACHE (0.51) ACHEMAOBMAOADRD2NPC1
SCHEMBL5953400 0.81 ACHE (0.51) ACHEMAOBMAOADRD2ABCB1
SCHEMBL5952120 0.81 ACHE (0.51) ACHEMAOBMAOADRD2ABCB1

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 ACHE 839/4885MAPT 3693/4885HPGD 132/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 ACHE 820/4885MAPT 3748/4885HPGD 159/4885

“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.