SCHEMBL31544142

SCHEMBL31544142

COC(=O)c1ccc2nc(Cl)c(C(=O)O)cc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.48
▸ CSNK2A1 P68400 1/20 0.46
▸ PTPN11 Q06124 1/20 0.44
▸ GRM1 Q13255 1/20 0.44
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ KDM4E B2RXH2 6/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ MAPT P10636 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ ATM Q13315 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ NFKB2 Q00653 1/20 0.43
▸ RELA Q04206 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL23756437 0.84 HTT (0.54) HTTALOX15RXFP1CSNK2A1PTPN11
SCHEMBL31544152 0.82 HTT (0.52) HTTALOX15RXFP1CSNK2A1GRM1
SCHEMBL31544181 0.80 CYP1A2 (0.51) HTTALOX15RXFP1CSNK2A1MEN1
SCHEMBL31544230 0.80 CYP1A2 (0.51) HTTALOX15RXFP1CSNK2A1MEN1
SCHEMBL17658964 0.79 KDM4E (0.57) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL31544141 0.79 ALDH1A1 (0.51) HTTALOX15RXFP1CSNK2A1GRM1
SCHEMBL30133943 0.79 CSNK2A1 (0.56) HTTALOX15CSNK2A1MEN1KMT2A
SCHEMBL5349000 0.79 CSNK2A1 (0.56) HTTALOX15CSNK2A1MEN1KMT2A
SCHEMBL26617865 0.78 RXFP1 (0.70) RXFP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL16945099 0.77 KMT2A (0.71) HTTMEN1KMT2AKDM4EALDH1A1

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-2025098450-A1 PRMT5 INHIBITOR AND PREPARATION METHOD THEREFOR 北京泰德制药股份有限公司 2025-05-15 — — WO disclosed
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