SCHEMBL30639064

SCHEMBL30639064

N#Cc1ccc2c(c1)C(=O)c1nc3ccc(CN4CCOCC4)cc3c(=O)n1-2

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 18/20 0.75
▸ IDO1 P14902 18/20 0.75
▸ IDO2 Q6ZQW0 10/20 0.75
▸ CHEK1 O14757 1/20 0.43
▸ CDK7 P50613 1/20 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
SCHEMBL26614140 1.00 TDO2 (0.75) TDO2IDO1IDO2CHEK1CDK7
SCHEMBL30639095 0.87 TDO2 (0.60) TDO2IDO1IDO2CHEK1CDK7
SCHEMBL26614224 0.87 TDO2 (0.60) TDO2IDO1IDO2CHEK1CDK7
SCHEMBL18133822 0.86 TDO2 (0.80) TDO2IDO1IDO2
SCHEMBL18133826 0.85 IDO1 (1.00) TDO2IDO1IDO2
SCHEMBL26863523 0.83 TDO2 (0.53) TDO2IDO1IDO2
SCHEMBL26614229 0.83 TDO2 (0.56) TDO2IDO1IDO2
SCHEMBL30639117 0.83 TDO2 (0.56) TDO2IDO1IDO2
Hydrochloric Acid SCHEMBL30639080 0.82 TDO2 (0.53) TDO2IDO1IDO2
Hydrochloric Acid SCHEMBL26614165 0.82 TDO2 (0.53) TDO2IDO1IDO2

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-4514804-A1 TRYPTANTHRIN DERIVATIVES AND USES THEREOF Viscient Bio, Inc. (US) 2025-03-05 — — EP disclosed
WO-2023211977-A1 TRYPTANTHRIN DERIVATIVES AND USES THEREOF VISCIENT BIO, INC. (US) 2023-11-02 — — WO disclosed
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