SCHEMBL24649660

SCHEMBL24649660

O=C(CCCS)NCCc1ccc(O)c(O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.71
▸ TRPV1 Q8NER1 4/20 0.71
▸ HSD17B10 Q99714 3/20 0.71
▸ MEN1 O00255 3/20 0.71
▸ KMT2A Q03164 3/20 0.71
▸ ERCC1 P07992 1/20 0.63
▸ ERCC4 Q92889 1/20 0.63
▸ HPGD P15428 3/20 0.62
▸ KDM4E B2RXH2 2/20 0.62
▸ LMNA P02545 2/20 0.62
▸ BLM P54132 2/20 0.62
▸ HIF1A Q16665 2/20 0.62
▸ NPC1 O15118 1/20 0.62
▸ GMNN O75496 1/20 0.62
▸ USP2 O75604 1/20 0.62
▸ TP53 P04637 1/20 0.62
▸ CYP1A2 P05177 1/20 0.62
▸ POLB P06746 1/20 0.62
▸ CYP3A4 P08684 1/20 0.62
▸ CYP2C9 P11712 1/20 0.62

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
SCHEMBL109158 0.88 MAPT (0.73) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL107219 0.86 MAPT (0.71) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL18273974 0.85 TRPV1 (0.75) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL23417638 0.85 MAPT (0.75) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL15933030 0.84 MAPT (0.66) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL29963045 0.84 MAPT (0.66) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL19033145 0.84 MAPT (0.73) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL19847584 0.84 TRPV1 (0.78) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL26998191 0.84 TRPV1 (0.97) MAPTTRPV1HSD17B10MEN1KMT2A
Palmitoyl Dopamine SCHEMBL875454 0.83 TRPV1 (1.00) MAPTTRPV1HSD17B10MEN1KMT2A

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
WO-2022243379-A1 THIOL-ENE-BASED POLYMERISABLE COMPOSITION KARL LEIBINGER MEDIZINTECHNIK GMBH & CO. KG (DE) 2022-11-24 — — WO disclosed
EP-4091599-A1 POLYMERIZABLE THIOL-ENE BASED COMPOSITION Karl Leibinger Medizintechnik Gmbh & Co. Kg (DE) 2022-11-23 — — EP disclosed
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