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Sugi Predict / Compounds / SCHEMBL30495641

SCHEMBL30495641

SCHEMBL30495641

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nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.53
▸ BACE1 P56817 8/20 0.49
▸ OPRM1 P35372 2/20 0.48
▸ OPRD1 P41143 2/20 0.48
▸ OPRK1 P41145 2/20 0.48
▸ CTSD P07339 2/20 0.48
▸ VIPR1 P32241 1/20 0.47
▸ OPRL1 P41146 1/20 0.47

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
SCHEMBL30432511 0.92 TFPI (0.52) TFPIBACE1CTSDVIPR1
SCHEMBL30262031 0.92 BACE1 (0.56) BACE1CTSDVIPR1
SCHEMBL30262131 0.91 TFPI (0.51) TFPIBACE1CTSDVIPR1OPRL1
SCHEMBL29777749 0.90 TFPI (0.50) TFPIOPRM1OPRD1OPRK1OPRL1
SCHEMBL21049246 0.90 BACE1 (0.52) TFPIBACE1OPRM1OPRD1OPRK1
SCHEMBL21049247 0.90 BACE1 (0.52) TFPIBACE1OPRM1OPRD1OPRK1
SCHEMBL29777778 0.89 TFPI (0.54) TFPIBACE1CTSD
SCHEMBL29453331 0.89 BACE1 (0.52) BACE1CTSDVIPR1
SCHEMBL31688353 0.89 TFPI (0.55) TFPIBACE1CTSD
SCHEMBL29378778 0.88 GLP1R (0.52) TFPIBACE1VIPR1

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
US-20230190887-A1 TARGETING G3BP AGGREGATION TO PREVENT NEURODEGENERATION UNIVERSITY OF SOUTH CAROLINA (US) 2023-06-22 — — US disclosed