SCHEMBL29973428

SCHEMBL29973428

C=C(Cc1nc(-c2ccc(OCCCC)c(F)c2)no1)C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GSTP1 P09211 7/20 0.40
▸ MAPK1 P28482 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ FFAR1 O14842 1/20 0.38
▸ TP53 P04637 1/20 0.37
▸ ACACB O00763 1/20 0.37
▸ ACACA Q13085 1/20 0.37

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
SCHEMBL23578220 1.00 GSTP1 (0.40) GSTP1MAPK1MAPTFFAR1TP53
SCHEMBL23588141 0.88 GSTP1 (0.43) GSTP1MAPK1MAPTFFAR1TP53
SCHEMBL23588077 0.86 ACACB (0.52) MAPTFFAR1TP53ACACBACACA
SCHEMBL27291368 0.84 ACACB (0.39) GSTP1MAPTTP53ACACBACACA
SCHEMBL23588102 0.80 SPHK1 (0.48) MAPTFFAR1TP53
SCHEMBL23588271 0.79 SPHK1 (0.53) —
SCHEMBL23588349 0.79 TP53 (0.41) GSTP1TP53
SCHEMBL23588068 0.79 SPHK2 (0.42) MAPK1TP53
SCHEMBL31707540 0.78 ACACB (0.38) MAPTTP53ACACBACACA
SCHEMBL25802125 0.78 MEN1 (0.46) GSTP1TP53

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-4081511-B3 CARBOXY DERIVATIVES WITH ANTIINFLAMMATORY PROPERTIES SITRYX THERAPEUTICS LTD (GB) 2026-03-04 — — EP disclosed
EP-4081511-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMMATORY PROPERTIES Sitryx Therapeutics Limited (GB) 2022-11-02 — — EP disclosed
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