SCHEMBL31583262

SCHEMBL31583262

O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1ccc(F)cc1[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.50
AR P10275 7/20 0.49
LMNA P02545 3/20 0.49
CYP3A4 P08684 2/20 0.49
HTT P42858 2/20 0.49
CES2 O00748 1/20 0.49
ABCB11 O95342 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP1A2 P05177 1/20 0.49
GLA P06280 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
CHRM1 P11229 1/20 0.49
CYP2C9 P11712 1/20 0.49
ALOX15 P16050 1/20 0.49
TSHR P16473 1/20 0.49
TBXA2R P21731 1/20 0.49
AADAC P22760 1/20 0.49
MAPK1 P28482 1/20 0.49
CYP2C19 P33261 1/20 0.49
ADRA1A P35348 1/20 0.49

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
SCHEMBL31583073 0.87 P2RX1 (0.66) LMNAHTTALDH1A1SMN1; SMN2GRM4
SCHEMBL5668773 0.87 P2RX1 (0.66) LMNAHTTALDH1A1SMN1; SMN2GRM4
SCHEMBL31582756 0.85 KDM4E (0.50) TRPV1ARLMNACYP3A4HTT
SCHEMBL31006905 0.84 TRPV1 (0.48) TRPV1ARLMNACYP3A4HTT
SCHEMBL25278208 0.82 RAB9A (0.51) TRPV1ARLMNACYP3A4HTT
SCHEMBL31006899 0.82 RAB9A (0.51) TRPV1ARLMNACYP3A4HTT
SCHEMBL30554610 0.80 AR (0.59) ARLMNACYP3A4HTTCES2
SCHEMBL3246949 0.80 AR (0.59) ARLMNACYP3A4HTTCES2
SCHEMBL1198183 0.79 LMNA (0.58) LMNAHTTALDH1A1MAPK1SMN1; SMN2
SCHEMBL1454916 0.77 LMNA (0.60) TRPV1LMNAHTTALDH1A1MAPK1

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-2025106780-A1 RXFP1 RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2025-05-22 WO disclosed