SCHEMBL5952912

SCHEMBL5952912

CC1Cc2cccc(-c3cc(O)cc(O)c3)c2C1=O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 10/20 0.50
MAOA P21397 2/20 0.43
MAOB P27338 2/20 0.43
TDP2 O95551 1/20 0.41
STAT3 P40763 1/20 0.41
ABCB1 P08183 2/20 0.38
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
HTR1A P08908 1/20 0.37
DRD2 P14416 1/20 0.37
DRD1 P21728 1/20 0.37
HSP90AB1 P08238 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
SCHEMBL5951226 0.90 TDP2 (0.52) ACHEMAOAMAOBTDP2STAT3
SCHEMBL5951497 0.87 ACHE (0.51) ACHEMAOAMAOBSTAT3ABCB1
SCHEMBL5952875 0.84 ACHE (0.51) ACHEMAOAMAOBSTAT3ABCB1
SCHEMBL5951255 0.84 ACHE (0.51) ACHEMAOAMAOBSTAT3ABCB1
SCHEMBL5951620 0.82 ACHE (0.54) ACHEMAOAMAOBHTR1ADRD2
SCHEMBL5952006 0.82 ACHE (0.50) ACHEMAOAMAOBSTAT3ABCB1
SCHEMBL5952340 0.82 ACHE (0.50) ACHEMAOAMAOBSTAT3
SCHEMBL5509273 0.81 ACHE (0.61) ACHEMAOAMAOBHTR1ADRD2
SCHEMBL5952103 0.80 ACHE (0.59) ACHEMAOAMAOBSTAT3ABCB1
SCHEMBL5951435 0.80 ACHE (0.54) ACHEABCB1ABL1BCRHTR1A

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 839/4885MAOA 498/4885MAOB 334/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 ACHE 820/4885MAOA 564/4885MAOB 403/4885

“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.