SCHEMBL5025935

SCHEMBL5025935

O=C(O)c1ccccc1C#Cc1ccccc1C(F)(c1ccccc1C#Cc1ccccc1C(=O)O)C(F)(F)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
FFAR1 O14842 2/20 0.40
ALDH1A1 P00352 5/20 0.38
ALOX15 P16050 2/20 0.38
TAS2R14 Q9NYV8 5/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
FABP4 P15090 1/20 0.36
LMNA P02545 2/20 0.35
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
HMGB1 P09429 1/20 0.34
HPGD P15428 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34

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
SCHEMBL1372606 0.82 ALDH1A1 (0.48) ALDH1A1ALOX15TAS2R14MEN1KMT2A
SCHEMBL2747573 0.81 FFAR1 (0.39) FFAR1PTGDR2LMNAGAASMN1; SMN2
SCHEMBL29409566 0.78 ALDH1A1 (0.62) NPC1RAB9AFFAR1ALDH1A1ALOX15
SCHEMBL69321 0.78 ALDH1A1 (0.62) NPC1RAB9AFFAR1ALDH1A1ALOX15
SCHEMBL2747178 0.75 FFAR1 (0.43) NPC1RAB9AFFAR1ALDH1A1PTGDR2
SCHEMBL2747181 0.75 HNF4A (0.40) NPC1RAB9AFFAR1ALDH1A1ALOX15
SCHEMBL8846924 0.75 ALDH1A1 (0.48) ALDH1A1ALOX15TAS2R14MEN1KMT2A
SCHEMBL3423138 0.74 TAS2R14 (0.40) ALDH1A1ALOX15TAS2R14MEN1KMT2A
SCHEMBL7150816 0.74 ALB (0.50) ALDH1A1ALOX15TAS2R14MEN1KMT2A
SCHEMBL2747575 0.74 TAS2R14 (0.38) ALDH1A1ALOX15TAS2R14MEN1KMT2A

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-8337982-B2 Comprising first repeating unit obtained by reaction of bisaminophenol compound and dicarboxylic acid, at least one of which has diamondoid structure and second repeating unit obtained by reaction of bisaminophenol compound having no diamondoid structure and dicarboxylic acid; heat resistance SUMITOMO BAKELITE CO., LTD. (JP) 2012-12-25 US disclosed
US-20080206548-A1 Benzoxazole Resin Precursor, Polybenzoxazole Resin, Resin Film And Semiconductor Device SUMITOMO BAKELITE CO., LTD (JP) 2008-08-28 US disclosed
EP-1832619-A1 BENZOXAZOLE RESIN PRECURSOR, POLYBENZOXAZOLE RESIN, RESIN FILM, AND SEMICONDUCTOR DEVICE Sumitomo Bakelite Company, Limited (JP) 2007-09-12 EP disclosed