SCHEMBL30739890

SCHEMBL30739890

CCNc1c(F)ccc(NC(=O)c2ccccc2)c1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.49
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
RAB9A P51151 6/20 0.48
NPC1 O15118 5/20 0.48
POLB P06746 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
MAPK1 P28482 2/20 0.45
HDAC3 O15379 1/20 0.45
HDAC2 Q92769 1/20 0.45
HPGD P15428 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KDR P35968 1/20 0.42
KCNK3 O14649 1/20 0.42

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
SCHEMBL30739729 0.85 SMN1; SMN2 (0.53) HDAC1HDAC8HDAC6RAB9ANPC1
SCHEMBL30739625 0.84 HDAC1 (0.52) HDAC1HDAC8HDAC6RAB9ANPC1
SCHEMBL30739776 0.81 ALDH1A1 (0.49) HDAC1HDAC8HDAC6RAB9ANPC1
SCHEMBL30739696 0.81 HDAC1 (0.44) HDAC1HDAC8HDAC6RAB9ANPC1
SCHEMBL28317699 0.81 PAX3 (0.44) HDAC1HDAC8HDAC6RAB9ANPC1
SCHEMBL30739675 0.81 HDAC1 (0.49) HDAC1HDAC8HDAC6RAB9ANPC1
SCHEMBL30740006 0.81 HDAC1 (0.49) HDAC1HDAC8HDAC6RAB9ANPC1
SCHEMBL30739828 0.80 MEN1 (0.61) HDAC1HDAC8HDAC6RAB9ANPC1
SCHEMBL30739591 0.80 HDAC1 (0.48) HDAC1HDAC8HDAC6RAB9ANPC1
SCHEMBL30739973 0.80 KDM4E (0.49) HDAC1HDAC8HDAC6RAB9ANPC1

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