SCHEMBL27353157

SCHEMBL27353157

CCCOc1cc2c(c(C(=O)O)c1)CCCC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
TSHR P16473 4/20 0.42
RXRA P19793 2/20 0.41
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
MAPK1 P28482 1/20 0.40
PPARG P37231 2/20 0.40
PTGES O14684 1/20 0.40
ALOX5 P09917 1/20 0.40
PPARA Q07869 1/20 0.40
PLA2G2A P14555 1/20 0.40
HTT P42858 1/20 0.40
PPARD Q03181 1/20 0.39
ALOX15 P16050 1/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL27353130 0.86 PPARG (0.40) KDM4CTSHRHSD17B10KDM4EALDH1A1
SCHEMBL7681591 0.80 CXCR5 (0.48) KMT2AKDM4CTSHRRXRAHSD17B10
SCHEMBL7042497 0.77 HTT (0.42) KMT2ATSHRPLA2G2AHTTLMNA
SCHEMBL7675116 0.77 ALDH1A1 (0.53) KMT2AKDM4CTSHRRXRAHSD17B10
SCHEMBL16546318 0.73 KMT2A (0.40) KMT2ATSHRKDM4EHPGDPPARG
SCHEMBL18304664 0.72 KAT6A (0.58) KMT2APLA2G2AHTTKAT6APTPN11
SCHEMBL166579 0.72 KMT2A (0.45) KMT2AKDM4EALDH1A1MAPTPLA2G2A
SCHEMBL30995621 0.71 SCN9A (0.33) TSHRRXRAHSD17B10KDM4EALDH1A1
SCHEMBL27353159 0.71 SCN9A (0.33) TSHRRXRAHSD17B10KDM4EALDH1A1
SCHEMBL8146895 0.70 KMT2A (0.58) KMT2ATSHRALDH1A1HTTLMNA

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-2024126650-A1 NOVEL BICYCLIC-CARBOXAMIDE COMPOUNDS USEFUL AS PESTICIDES SYNGENTA CROP PROTECTION AG (CH) 2024-06-20 WO disclosed