SCHEMBL31365079

SCHEMBL31365079

Cc1ccc([N+](=O)[O-])c(NC(=O)OC(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KAT2B Q92831 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KCNMA1 Q12791 1/20 0.43
LMNA P02545 1/20 0.43
NPSR1 Q6W5P4 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
SCHEMBL27804103 0.89 SMN1; SMN2 (0.49) MAPTCYP3A4TSHRSMN1; SMN2ALDH1A1
SCHEMBL31365089 0.89 ALDH1A1 (0.58) MAPTCYP3A4SMN1; SMN2ALDH1A1NPC1
SCHEMBL8231247 0.89 ALDH1A1 (0.58) MAPTCYP3A4SMN1; SMN2ALDH1A1NPC1
SCHEMBL6433978 0.87 RXFP1 (0.54) MAPTSMN1; SMN2NPC1RAB9AKCNMA1
SCHEMBL30118370 0.86 SMN1; SMN2 (0.45) MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL13833547 0.86 SMN1; SMN2 (0.45) MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL2134731 0.86 SMN1; SMN2 (0.45) MAPTCYP3A4SMN1; SMN2ALDH1A1NPC1
SCHEMBL6674647 0.86 L3MBTL1 (0.54) MAPTTSHRSMN1; SMN2ALDH1A1KCNMA1
SCHEMBL1130860 0.85 SMN1; SMN2 (0.66) MAPTCYP3A4SMN1; SMN2ALDH1A1HPGD
SCHEMBL27782492 0.84 SMN1; SMN2 (0.47) MAPTSMN1; SMN2ALDH1A1LMNA

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
EP-4741395-A1 NOVEL COMPOUND SENSITIVE TO NITROGEN MONOXIDE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Omniamed Co. Ltd (KR) 2026-05-13 EP disclosed
WO-2025009922-A1 NOVEL COMPOUND SENSITIVE TO NITROGEN MONOXIDE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 옴니아메드 2025-01-09 WO disclosed