SCHEMBL5285568

SCHEMBL5285568

Cc1cc(OC(=O)c2cc(F)c(F)cc2F)ccc1C(C)C

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.55
PLA2G1B P04054 1/20 0.55
ATG4B Q9Y4P1 1/20 0.55
FKBP1A P62942 1/20 0.43
MAPT P10636 2/20 0.40
POLB P06746 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
CARM1 Q86X55 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL5284469 0.80 TDP1 (0.54) TDP1PLA2G1BATG4BFKBP1AMAPT
SCHEMBL364782 0.77 MAPT (0.50) MAPTMEN1KMT2ACYP1A2CYP2C19
SCHEMBL3904552 0.76 TDP1 (0.58) TDP1PLA2G1BATG4BFKBP1ACARM1
SCHEMBL11482491 0.74 TDP1 (0.57) TDP1PLA2G1BATG4BFKBP1AMAPT
SCHEMBL9946003 0.73 TDP1 (0.54) TDP1PLA2G1BATG4BFKBP1AMEN1
SCHEMBL20439411 0.72 RAB9A (0.56) TDP1PLA2G1BATG4BFKBP1AMEN1
SCHEMBL6248013 0.71 TDP1 (0.53) TDP1PLA2G1BATG4BFKBP1AMAPT
SCHEMBL26500618 0.71 TDP1 (0.53) TDP1PLA2G1BATG4BFKBP1AMEN1
SCHEMBL826069 0.71 HSD17B10 (0.55) TDP1MAPTPOLBKMT2AESR1
SCHEMBL8002538 0.70 PLA2G1B (0.50) TDP1PLA2G1BATG4BMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007004753-A1 ALKYLPHENOL DERIVATIVES HAVING PHYTOPATHOGENIC FUNGI ACTIVITIES DONGBU HITEK CO., LTD. (KR) 2007-01-11 WO claimed
WO-2007004753-A1 ALKYLPHENOL DERIVATIVES HAVING PHYTOPATHOGENIC FUNGI ACTIVITIES DONGBU HITEK CO., LTD. (KR) 2007-01-11 WO disclosed