SCHEMBL24131026

SCHEMBL24131026

CC(C)c1cc2[nH]ncc2c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 9/20 0.51
▸ TRPA1 O75762 2/20 0.47
▸ IDO1 P14902 7/20 0.43

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
SCHEMBL10594461 0.78 METAP2 (0.53) METAP2TRPA1IDO1
SCHEMBL25081099 0.75 IDO1 (0.56) METAP2TRPA1IDO1
SCHEMBL23338155 0.75 METAP2 (0.58) METAP2TRPA1IDO1
SCHEMBL16675976 0.74 METAP2 (0.49) METAP2TRPA1IDO1
SCHEMBL681910 0.74 METAP2 (0.49) METAP2TRPA1IDO1
SCHEMBL26302437 0.73 METAP2 (0.52) METAP2TRPA1IDO1
SCHEMBL18398743 0.73 IDO1 (0.55) METAP2IDO1
SCHEMBL10594265 0.73 NOS1 (0.53) METAP2TRPA1IDO1
SCHEMBL2611042 0.73 IDO1 (0.55) METAP2TRPA1IDO1
SCHEMBL24131138 0.72 TRPA1 (0.50) METAP2TRPA1IDO1

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-2021258010-A1 OXIME COMPOUNDS USEFUL AS T CELL ACTIVATORS GOSSAMER BIO SERVICES, INC. (US) 2021-12-23 — — WO disclosed
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