SCHEMBL31325583

SCHEMBL31325583

NC(=O)c1nc(Cl)c(N)nc1N

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCNN1A P37088 8/20 0.63
▸ ALDH1A1 P00352 7/20 0.63
▸ HSD17B10 Q99714 7/20 0.63
▸ KDM4E B2RXH2 6/20 0.63
▸ HPGD P15428 6/20 0.63
▸ CYP1A2 P05177 6/20 0.63
▸ GLA P06280 5/20 0.63
▸ CYP2D6 P10635 4/20 0.63
▸ GAA P10253 3/20 0.63
▸ LMNA P02545 3/20 0.63
▸ PLAU P00749 3/20 0.63
▸ FTO Q9C0B1 3/20 0.63
▸ TSHR P16473 3/20 0.63
▸ BLM P54132 2/20 0.63
▸ SLC9A1 P19634 2/20 0.63
▸ SLC22A1 O15245 1/20 0.63
▸ HTR1A P08908 1/20 0.63
▸ MAOA P21397 1/20 0.63
▸ ADORA2A P29274 1/20 0.63
▸ CYP2C19 P33261 1/20 0.63

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
SCHEMBL805324 1.00 SCNN1A (0.63) SCNN1AALDH1A1HSD17B10KDM4EHPGD
Hydrochloric Acid SCHEMBL11496167 0.98 ALDH1A1 (0.65) SCNN1AALDH1A1HSD17B10KDM4EHPGD
Acetic Acid SCHEMBL27779574 0.92 SCNN1A (0.56) SCNN1AALDH1A1HSD17B10KDM4EHPGD
Trifluoroacetic Acid SCHEMBL27779034 0.89 SCNN1A (0.53) SCNN1AALDH1A1HSD17B10KDM4EHPGD
SCHEMBL14237878 0.88 PLAU (0.50) SCNN1AALDH1A1HSD17B10KDM4EHPGD
SCHEMBL11778516 0.83 PDPK1 (0.58) SCNN1AALDH1A1HSD17B10KDM4EHPGD
SCHEMBL23337629 0.82 SCNN1A (0.58) SCNN1AALDH1A1HSD17B10KDM4EHPGD
SCHEMBL1134621 0.82 SCNN1A (0.58) SCNN1AALDH1A1HSD17B10KDM4EHPGD
SCHEMBL31647638 0.82 SCNN1A (0.58) SCNN1AALDH1A1HSD17B10KDM4EHPGD
SCHEMBL25950177 0.81 PLAU (0.44) SCNN1AALDH1A1HSD17B10KDM4EHPGD

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-119325465-A Biphenyl substituted epithelial sodium channel blocking compounds 帕里昂科学公司 2025-01-17 — — CN disclosed
Send feedback