SCHEMBL9056337

SCHEMBL9056337

Cc1cc(C)c2c(c1)C(=O)CC2(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.44
TDP1 Q9NUW8 1/20 0.36
HTT P42858 3/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 4/20 0.35
ATM Q13315 2/20 0.34
BRD4 O60885 1/20 0.33
TSHR P16473 1/20 0.33
RAD52 P43351 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
CYP2C19 P33261 1/20 0.32
THRB P10828 1/20 0.31

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
SCHEMBL6262202 0.76 PGR (0.46) PGRALDH1A1KDM4EMEN1KMT2A
SCHEMBL11813866 0.72 KDM4E (0.33) HTTALDH1A1KDM4EATMBRD4
SCHEMBL5408306 0.70 ALDH1A1 (0.37) PGRTDP1HTTALDH1A1
SCHEMBL7837477 0.69 TYMS (0.34) PGRHTTALDH1A1BRD4TSHR
SCHEMBL568994 0.69 PGR (0.55) PGRHTTALDH1A1KDM4EATM
SCHEMBL3368781 0.69 TSHR (0.42) PGRHTTALDH1A1KDM4EBRD4
SCHEMBL1455080 0.69 ALDH1A1 (0.41) ALDH1A1KDM4ETSHRMEN1KMT2A
SCHEMBL4830158 0.68 PGR (0.50) PGRTDP1HTTALDH1A1KDM4E
SCHEMBL17391093 0.66 PGR (0.35) PGRTDP1HTTALDH1A1KDM4E
SCHEMBL3368868 0.65 PGR (0.69) PGRHTTALDH1A1KDM4EATM

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
JP-6009483-A None JP disclosed
EP-0567953-B1 Process for the preparation of substituted indanones HOECHST AG (DE) 1996-03-13 EP disclosed
US-5329049-A Process for the preparation of substituted indanones HOECHST AKTIENGESELLSCHAFT (DE) 1994-07-12 US disclosed
JP-H069483-A PREPARATION OF SUBSTITUTED INDANONES HOECHST AG 1994-01-18 JP disclosed
EP-0567953-A1 Process for the preparation of substituted indanones HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 EP disclosed