SCHEMBL29079501

SCHEMBL29079501

NCCCP(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.43
MAOA P21397 1/20 0.39
LTA4H P09960 1/20 0.38
PLA2G2A P14555 1/20 0.38
KCNA3 P22001 1/20 0.38
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38

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
SCHEMBL11074250 0.87 KCNA3 (0.44) TAAR1MAOALTA4HKCNA3HRH1
SCHEMBL685511 0.79 ALDH1A1 (0.43) LTA4HKCNA3
SCHEMBL4451586 0.79 LTA4H (0.47) MAOALTA4HKCNA3HTR2AHRH1
SCHEMBL6741371 0.76 LTA4H (0.46) MAOALTA4HHTR2AHRH1
SCHEMBL6745882 0.76 LTA4H (0.46) MAOALTA4HHTR2AHRH1
SCHEMBL6857868 0.76 LTA4H (0.46) MAOALTA4HHTR2AHRH1
SCHEMBL6742130 0.76 LTA4H (0.46) MAOALTA4HHTR2AHRH1
SCHEMBL4456043 0.74 LTA4H (0.41) LTA4HKCNA3
SCHEMBL21469853 0.72 DRD2 (0.43) TAAR1MAOAHTR2A
SCHEMBL8902684 0.72 LTA4H (0.43) TAAR1MAOALTA4HKCNA3

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
CN-116815496-A Dustproof and corrosion-resistant fabric and preparation method thereof 吴江市兴业纺织有限公司 2023-09-29 CN claimed