SCHEMBL14948813

SCHEMBL14948813

Clc1cccnc1-n1c(I)cc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.39
RPS6KA5 O75582 4/20 0.38
ALDH1A1 P00352 1/20 0.37
TRPV1 Q8NER1 2/20 0.37
RPS6KA4 O75676 1/20 0.37
CCR1 P32246 1/20 0.35
CCR8 P51685 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CASP6 P55212 1/20 0.34
GRM4 Q14833 1/20 0.34
NR4A2 P43354 1/20 0.33

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
SCHEMBL14948764 0.82 TRPV1 (0.42) METALDH1A1TRPV1L3MBTL1
SCHEMBL14948814 0.79 TRPV1 (0.38) METALDH1A1TRPV1
SCHEMBL14948825 0.77 ALDH1A1 (0.56) ALDH1A1GRM4
SCHEMBL12528692 0.70 MYC (0.47) RPS6KA5TRPV1
SCHEMBL14948840 0.70 KDR (0.47) ALDH1A1L3MBTL1GRM4
SCHEMBL26387008 0.67 LMNA (0.36) RPS6KA5ALDH1A1TRPV1RPS6KA4
SCHEMBL951504 0.67 HSD11B1 (0.34) METALDH1A1
SCHEMBL14948773 0.66 TRPV1 (0.39) TRPV1
SCHEMBL951449 0.66 MYC (0.43) TRPV1
SCHEMBL28388699 0.65 ALDH1A1 (0.39) ALDH1A1

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
WO-2013069771-A1 ANTHRANILIC ACID DERIVATIVE AND NOXIOUS ORGANISM CONTROL AGENT Meiji Seikaファルマ株式会社 (JP) 2013-05-16 WO disclosed