SCHEMBL8403244

SCHEMBL8403244

COc1ccc(C(=O)c2cc(F)c(C)n2C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 3/20 0.50
▸ ALOX15 P16050 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ HTT P42858 2/20 0.50
▸ GAA P10253 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ NPC1 O15118 2/20 0.45
▸ TUBB4A P04350 1/20 0.45
▸ TUBB P07437 1/20 0.45
▸ TUBA3C P0DPH7 1/20 0.45
▸ TUBA1B P68363 1/20 0.45
▸ TUBA4A P68366 1/20 0.45
▸ TUBB4B P68371 1/20 0.45

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
SCHEMBL8401817 0.84 ALDH1A1 (0.50) ALDH1A1LMNAHTTGAAMAPT
SCHEMBL8399865 0.80 ALDH1A1 (0.46) NPSR1ALOX15ALDH1A1LMNAHTT
SCHEMBL257469 0.76 ATM (0.44) NPSR1ALDH1A1LMNAMAPTRAB9A
SCHEMBL8403575 0.75 LMNA (0.45) NPSR1ALOX15ALDH1A1LMNAHTT
SCHEMBL15100717 0.73 LMNA (0.55) NPSR1ALOX15ALDH1A1LMNAHTT
SCHEMBL6113460 0.72 HPGD (0.62) NPSR1ALDH1A1LMNAHTTGAA
SCHEMBL10877250 0.72 ALDH1A1 (0.49) NPSR1ALOX15ALDH1A1LMNAHTT
SCHEMBL9418310 0.72 RXFP1 (0.79) NPSR1ALDH1A1LMNAGAAMAPT
SCHEMBL51509 0.72 RXFP1 (0.79) NPSR1ALDH1A1LMNAGAAMAPT
SCHEMBL5509927 0.71 KDM4E (0.66) NPSR1ALDH1A1LMNAHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952368-A AN INHIBITORS OF PROSTAGLANDIN G/H SYNTHASE, ANTIINFLAMMATORY AND ANALGESIC AGENTS SYNTEX (U.S.A.) INC. (US) 1999-09-14 — — US disclosed
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