SCHEMBL30806936

SCHEMBL30806936

Nc1nc2cc([N+](=O)[O-])ccc2n(Cc2ccccc2)c1=O

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 8/20 0.65
▸ ALOX5 P09917 2/20 0.57
▸ PTGS2 P35354 2/20 0.57
▸ ALOX15 P16050 1/20 0.57
▸ MEN1 O00255 4/20 0.52
▸ KMT2A Q03164 4/20 0.52
▸ GAA P10253 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ DHFR P00374 1/20 0.49
▸ KAT2B Q92831 1/20 0.48

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
SCHEMBL30806419 0.86 CFTR (0.60) CFTRALOX5PTGS2ALOX15MEN1
SCHEMBL28987743 0.81 MEN1 (0.71) CFTRALOX5PTGS2ALOX15MEN1
SCHEMBL31441369 0.81 MEN1 (0.71) CFTRALOX5PTGS2ALOX15MEN1
SCHEMBL19032835 0.80 CFTR (0.81) CFTRALOX5PTGS2ALOX15MEN1
SCHEMBL19046220 0.79 CFTR (0.80) CFTRALOX5PTGS2ALOX15MEN1
SCHEMBL19032802 0.79 CFTR (0.80) CFTRALOX5PTGS2ALOX15MEN1
SCHEMBL19032095 0.79 CFTR (1.00) CFTR
SCHEMBL29478065 0.79 CFTR (1.00) CFTR
SCHEMBL30807014 0.78 PKM (0.55) CFTRALOX5PTGS2ALOX15MEN1
SCHEMBL12165517 0.78 CNR2 (0.47) CFTRALOX5PTGS2ALOX15MEN1

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-4561561-A2 SUBSTITUTED 3,4-DIHYDROQUINOLINONE INHIBITORS OF TSHR Septerna, Inc. (US) 2025-06-04 — — EP disclosed
WO-2024026076-A2 SUBSTITUTED 3,4-DIHYDROQUINOLINONE INHIBITORS OF TSHR SEPTERNA, INC. (US) 2024-02-01 — — WO disclosed
Send feedback