SCHEMBL30739607

SCHEMBL30739607

CC(=O)Nc1c(Cl)ccc(C(=O)O)c1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CLCN2 P51788 7/20 0.51
▸ KDM4E B2RXH2 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ MEN1 O00255 1/20 0.44
▸ AKR1B10 O60218 1/20 0.44
▸ ABCB11 O95342 1/20 0.44
▸ TTR P02766 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ CHRM1 P11229 1/20 0.44
▸ FABP2 P12104 1/20 0.44
▸ RXRA P19793 1/20 0.44
▸ TBXA2R P21731 1/20 0.44
▸ NR4A1 P22736 1/20 0.44
▸ PTGS1 P23219 1/20 0.44
▸ PDE4A P27815 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ PTGS2 P35354 1/20 0.44
▸ AKR1C3 P42330 1/20 0.44
▸ NR4A2 P43354 1/20 0.44
▸ AKR1C2 P52895 1/20 0.44

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
SCHEMBL670482 1.00 CLCN2 (0.51) CLCN2KDM4EHSD17B10MEN1AKR1B10
SCHEMBL8578051 0.86 KDM4E (0.47) CLCN2KDM4EHSD17B10MEN1AKR1B10
SCHEMBL670931 0.83 KDM4E (0.45) CLCN2KDM4EHSD17B10MEN1AKR1B10
SCHEMBL27962476 0.82 ALDH1A1 (0.49) CLCN2KDM4EHSD17B10MEN1AKR1B10
SCHEMBL2113108 0.79 ALDH1A1 (0.57) CLCN2KDM4EHSD17B10MEN1AKR1B10
SCHEMBL8130619 0.78 ALDH1A1 (0.67) CLCN2MEN1AKR1B10ABCB11TTR
SCHEMBL21409466 0.78 CLCN2 (0.47) CLCN2KDM4EMEN1MAPK1KMT2A
SCHEMBL20051336 0.76 CDC7 (0.47) KDM4EALDH1A1TSHRLMNACDC7
SCHEMBL13715488 0.76 KDM4E (0.62) CLCN2KDM4EHSD17B10MEN1KMT2A
SCHEMBL30739877 0.76 CDC7 (0.47) KDM4EALDH1A1TSHRLMNACDC7

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
Send feedback