SCHEMBL14390906

SCHEMBL14390906

Oc1cc(Br)cc2c1CCCO2

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.38
▸ ALOX12 P18054 2/20 0.38
▸ MAPT P10636 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ MEN1 O00255 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ PIK3CA P42336 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ALOX5 P09917 1/20 0.30

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
SCHEMBL3190996 0.81 MAOA (0.37) ALOX15ALOX12MAPTLMNAHTT
SCHEMBL30392289 0.81 MAOA (0.37) ALOX15ALOX12MAPTLMNAHTT
SCHEMBL31204901 0.78 LMNA (0.35) MAPTLMNAHTTBLMSMN1; SMN2
SCHEMBL10033616 0.78 FFAR4 (0.37) MAPTLMNASMN1; SMN2MEN1GAA
SCHEMBL13114497 0.76 SMN1; SMN2 (0.53) ALOX15MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL21500712 0.76 ALOX5 (0.31) NPC1RAB9AALOX5
SCHEMBL15628793 0.75 ALDH1A1 (0.32) HPGD
SCHEMBL21500751 0.74 SMN1; SMN2 (0.32) SMN1; SMN2NPC1RAB9AALOX5
SCHEMBL18809447 0.74 HSP90AA1 (0.32) MAPTSMN1; SMN2NPC1RAB9AHPGD
SCHEMBL14541022 0.71 PGR (0.46) MAPTSMN1; SMN2MEN1KMT2ANPC1

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
EP-1572203-B1 SUBSTITUTED 4-ALKOXYOXAZOL DERIVATIVES AS PPAR AGONISTS HOFFMANN LA ROCHE (CH) 2007-11-07 — — EP disclosed
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