SCHEMBL29954715

SCHEMBL29954715

COc1ccccc1C(=O)C=O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.64
CTSD P07339 1/20 0.55
GPR52 Q9Y2T5 1/20 0.54
ABCB1 P08183 1/20 0.54
NPC1 O15118 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
STAT3 P40763 1/20 0.51
MAOB P27338 2/20 0.51
AR P10275 2/20 0.50
HTT P42858 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
RAB9A P51151 1/20 0.50
KCNK3 O14649 1/20 0.49
KCNK9 Q9NPC2 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
SCHEMBL1697561 1.00 ABCG2 (0.64) ABCG2CTSDGPR52ABCB1NPC1
Water SCHEMBL3048073 0.98 ABCG2 (0.62) ABCG2CTSDGPR52ABCB1NPC1
SCHEMBL11267816 0.90 KMT2A (0.58) ABCG2CTSDGPR52ABCB1NPC1
SCHEMBL31167606 0.86 ABCG2 (0.77) ABCG2CTSDGPR52ABCB1NPC1
SCHEMBL31561740 0.84 ABCG2 (0.64) ABCG2CTSDGPR52ABCB1NPC1
SCHEMBL7469828 0.84 ABCG2 (0.64) ABCG2CTSDGPR52ABCB1NPC1
SCHEMBL9178467 0.84 ABCG2 (0.64) ABCG2CTSDGPR52ABCB1NPC1
SCHEMBL6635025 0.83 NPC1 (0.50) ABCG2NPC1SMN1; SMN2HTTRAB9A
SCHEMBL7936407 0.83 TLR2 (0.56) ABCG2NPC1SMN1; SMN2MAOBAR
SCHEMBL15821571 0.82 ABCG2 (0.62) ABCG2CTSDGPR52ABCB1NPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688772-A1 BIARYL DERIVATIVES AND RELATED USES Moma Therapeutics, Inc. (US) 2026-02-11 EP disclosed
WO-2024211834-A1 BIARYL DERIVATIVES AND RELATED USES MOMA THERAPEUTICS, INC. (US) 2024-10-10 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed