SCHEMBL8048151

SCHEMBL8048151

COCc1nnc(Sc2nc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cs2)s1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 1/20 0.37
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALOX5 P09917 1/20 0.32
RORB Q92753 1/20 0.32
CACNA1H O95180 1/20 0.32
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
EIF4E P06730 1/20 0.31
PPARD Q03181 1/20 0.31
CXCR3 P49682 1/20 0.31
LTA4H P09960 1/20 0.30
RAB9A P51151 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
SCHEMBL8046557 0.87 CTSS (0.35) F2RL3ALDH1A1L3MBTL1MAPTHSD17B10
SCHEMBL8048125 0.85 CTSK (0.41) F2RL3ALDH1A1L3MBTL1MAPTALOX5
SCHEMBL8033655 0.85 EIF4E (0.34) F2RL3ALDH1A1L3MBTL1MAPTALOX5
SCHEMBL8050843 0.84 CTSS (0.38) F2RL3ALDH1A1L3MBTL1MAPTALOX5
SCHEMBL8044775 0.83 EIF4E (0.33) F2RL3ALDH1A1L3MBTL1MAPTALOX5
SCHEMBL8033608 0.81 EIF4E (0.40) ALDH1A1L3MBTL1RORBEIF4EPPARD
SCHEMBL8042665 0.81 MAPT (0.41) F2RL3POLBMAPTLMNAPKM
SCHEMBL8048108 0.80 KMT2A (0.40) ALDH1A1L3MBTL1POLBMAPTPKM
SCHEMBL8046645 0.80 ALDH1A1 (0.39) ALDH1A1L3MBTL1LMNAALOX5RORB
SCHEMBL8043455 0.80 LTA4H (0.42) ALDH1A1ALOX5EIF4ELTA4HRAB9A

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-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed