SCHEMBL30739775

SCHEMBL30739775

Cc1cc(NCc2ccc(C(F)(F)F)cc2)ccc1NC(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
GAA P10253 1/20 0.52
TP53 P04637 1/20 0.51
CTNNB1 P35222 2/20 0.51
TCF7L2 Q9NQB0 2/20 0.51
PPARA Q07869 1/20 0.51
MAPT P10636 2/20 0.50
CYP1A2 P05177 2/20 0.50
FFAR1 O14842 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
PTGDR2 Q9Y5Y4 1/20 0.49
TRPA1 O75762 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
P2RX1 P51575 1/20 0.49
HDAC1 Q13547 1/20 0.48

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
SCHEMBL30739785 0.87 POLB (0.58) POLBTP53MAPTCYP1A2MEN1
SCHEMBL30739593 0.87 CTNNB1 (0.55) POLBTP53CTNNB1TCF7L2PPARA
SCHEMBL30739706 0.84 HDAC1 (0.64) POLBNPC1RAB9APPARAMAPT
SCHEMBL30739866 0.82 KMT2A (0.57) POLBNPC1RAB9AMAPTCYP1A2
SCHEMBL2070590 0.82 KCNQ2 (0.65) RAB9APPARAMAPTCYP1A2FFAR1
SCHEMBL2069321 0.82 FFAR1 (0.50) RAB9ACTNNB1TCF7L2PPARAMAPT
SCHEMBL30796364 0.82 KCNQ2 (0.65) RAB9APPARAMAPTCYP1A2FFAR1
SCHEMBL30796062 0.82 FFAR1 (0.50) RAB9ACTNNB1TCF7L2PPARAMAPT
SCHEMBL6696272 0.81 FFAR1 (0.49) POLBNPC1RAB9APPARAMAPT
SCHEMBL5973327 0.81 HPGD (0.56) POLBRAB9APPARAMAPTCYP1A2

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