SCHEMBL31735528

SCHEMBL31735528

Cc1c(-c2ccc(C(=O)O)cc2)cnn(C)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.46
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
BRD4 O60885 2/20 0.43
BRD9 Q9H8M2 2/20 0.43
PTGS2 P35354 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
HSP90AA1 P07900 1/20 0.43
NFKB1 P19838 1/20 0.43
RAB9A P51151 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
MAP4K4 O95819 2/20 0.42
CHEK1 O14757 1/20 0.42
ADORA2A P29274 2/20 0.40
ADORA2B P29275 2/20 0.40
ADORA1 P30542 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PTGS1 P23219 1/20 0.39

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
SCHEMBL31735660 0.84 ALDH1A1 (0.49) HPGDBRD4BRD9SMN1; SMN2ADORA2A
SCHEMBL25099090 0.83 CYP11B2 (0.55) HPGDRXRARXRBBRD4SMN1; SMN2
SCHEMBL12263261 0.72 HPGD (0.44) HPGDMAP4K4CHEK1ADORA2AADORA2B
SCHEMBL28376237 0.70 ALDH1A1 (0.56) RXRARXRBSMN1; SMN2MAP4K4ALDH1A1
SCHEMBL18420453 0.69 AKT1 (0.46) HPGDRXRARXRBMAP4K4CHEK1
SCHEMBL18420397 0.69 AKT1 (0.48) HPGDRXRARXRBMAP4K4CHEK1
SCHEMBL30620654 0.69 CYP11B2 (0.54) BRD4BRD9MAP4K4CREBBPCYP11B2
SCHEMBL3330685 0.68 GPR119 (0.46) HPGDRXRARXRBSMN1; SMN2RAB9A
SCHEMBL12263289 0.67 HPGD (0.46) HPGDRXRARXRBSMN1; SMN2ALDH1A1
SCHEMBL24369883 0.67 CYP11B2 (0.51) HPGDBRD4SMN1; SMN2ADORA2AADORA2B

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-2025245484-A1 FOXN1 ACTIVATORS THYMOFOX INC. (US) 2025-11-27 WO disclosed