SCHEMBL8993158

SCHEMBL8993158

COC(=O)c1ccc(Cc2ccccc2)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 7/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
LOXL2 Q9Y4K0 1/20 0.48
TSHR P16473 1/20 0.47
HPGD P15428 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
LMNA P02545 1/20 0.47
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47

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
SCHEMBL11159464 0.86 SMN1; SMN2 (0.52) CA1CA2ALDH1A1MEN1KMT2A
SCHEMBL6815303 0.84 LMNA (0.58) HSP90AA1CA1CA2LOXL2TSHR
SCHEMBL8993073 0.82 MAPT (0.51) CA1CA2ALDH1A1KMT2ALOXL2
SCHEMBL27168760 0.82 LOXL2 (0.51) CA1CA2ALDH1A1KMT2ALOXL2
SCHEMBL15778501 0.81 ALDH1A1 (0.53) CA1CA2ALDH1A1MEN1KMT2A
SCHEMBL6825689 0.81 CA1 (0.56) HSP90AA1CA1CA2ALDH1A1MEN1
SCHEMBL2332196 0.80 ALDH1A1 (0.49) CA1CA2ALDH1A1MEN1KMT2A
SCHEMBL38658158 0.80 NR4A2 (0.57) ALDH1A1MEN1KMT2ATSHRNPC1
SCHEMBL20236579 0.80 HIF1A (0.62) CA1CA2ALDH1A1MEN1KMT2A
SCHEMBL7651523 0.80 ALDH1A1 (0.51) CA1CA2ALDH1A1MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516777-A PROSTATE CANCER THERAPY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-05-14 US disclosed
US-5409928-A Prostate diseases, alopecia OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-04-25 US disclosed
EP-0594149-A2 Condensed pyrazole derivatives, method of manufacturing the same, and androgen inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-04-27 EP disclosed