SCHEMBL30739720

SCHEMBL30739720

Cc1cccc(C(=O)Nc2ccc(F)cc2F)c1F

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
ALDH1A1 P00352 2/20 0.55
POLB P06746 1/20 0.53
PKM P14618 1/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
TAS1R3 Q7RTX0 1/20 0.52
TAS1R1 Q7RTX1 1/20 0.52
TAS1R2 Q8TE23 1/20 0.52
KDM4E B2RXH2 1/20 0.51
KLK7 P49862 1/20 0.51
HTT P42858 2/20 0.50
GAA P10253 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL12225784 0.88 MAPT (0.66) MAPTALDH1A1POLBPKMNPC1
SCHEMBL30739657 0.88 MAPT (0.66) MAPTALDH1A1POLBPKMNPC1
SCHEMBL30739587 0.87 MAPT (0.63) MAPTALDH1A1POLBPKMNPC1
SCHEMBL30739829 0.84 MAPT (0.60) MAPTALDH1A1POLBPKMNPC1
SCHEMBL22820217 0.82 LMNA (0.56) MAPTALDH1A1POLBPKMNPC1
SCHEMBL30599567 0.80 MAPT (0.71) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL20423296 0.80 CYP1A2 (0.61) MAPTALDH1A1POLBPKMNPC1
SCHEMBL18160284 0.79 LMNA (0.61) MAPTPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL30739949 0.79 LMNA (0.61) MAPTPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL30739737 0.78 NPC1 (0.61) MAPTALDH1A1NPC1RAB9ASMN1; SMN2

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
CN-118044519-A Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-05-17 CN disclosed
CN-110072842-B Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-02-02 CN disclosed