SCHEMBL10413638

SCHEMBL10413638

Nc1ccc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(Oc2ccc(C(c3ccc(Oc4cc(N)ccc4C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)(C(F)(F)F)C(F)(F)F)cc2)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 3/20 0.34
NPC1 O15118 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
LMNA P02545 1/20 0.34
ATM Q13315 1/20 0.34
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAOB P27338 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
SCHEMBL10414131 0.96 RAB9A (0.37) RAB9AL3MBTL1MAPTNPC1ALDH1A1
SCHEMBL9736024 0.89 L3MBTL1 (0.39) RAB9AL3MBTL1MAPTNPC1ALDH1A1
SCHEMBL9737743 0.88 L3MBTL1 (0.38) RAB9AL3MBTL1MAPTNPC1ALDH1A1
SCHEMBL9737599 0.88 L3MBTL1 (0.38) RAB9AL3MBTL1MAPTNPC1ALDH1A1
SCHEMBL9736659 0.81 NR4A1 (0.37) RAB9AL3MBTL1MAPTNPC1ALDH1A1
SCHEMBL10413667 0.81 NR4A1 (0.37) RAB9AL3MBTL1MAPTNPC1ALDH1A1
SCHEMBL9735774 0.80 NR4A1 (0.36) RAB9AL3MBTL1MAPTNPC1ALDH1A1
SCHEMBL9737990 0.80 NR4A1 (0.36) RAB9AL3MBTL1MAPTNPC1ALDH1A1
SCHEMBL8767449 0.79 L3MBTL1 (0.41) RAB9AL3MBTL1MAPTNPC1ALDH1A1
SCHEMBL8761195 0.79 RAB9A (0.40) RAB9AL3MBTL1MAPTNPC1ALDH1A1

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-4965339-A CYCLIZATION OF A POLYAMIC ACID HAVING PERFLUOROALKYL GROUPS IN A SOLVENT IN THE PRSENCE OF A LOWER FATTY MONCARBOXYLIC ACID ANHYDRIDE AND A TERTIARY AMINE; COATINGS; FILMS CENTRAL GLASS COMPANY, LIMITED (JP) 1990-10-23 US disclosed