SCHEMBL19937653

SCHEMBL19937653

C[C@@H]1C=Cc2oc3cnccc3c2C=C1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 15/20 0.38
▸ IDO1 P14902 11/20 0.34
▸ ROCK2 O75116 1/20 0.32

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
SCHEMBL19257399 0.74 TDO2 (0.35) TDO2IDO1ROCK2
SCHEMBL19309592 0.68 IDO1 (0.33) TDO2IDO1ROCK2
SCHEMBL21315928 0.68 TDO2 (0.35) TDO2IDO1
SCHEMBL11885001 0.68 IDO1 (0.46) TDO2IDO1ROCK2
SCHEMBL20124311 0.67 KDM4E (0.35) —
SCHEMBL21277202 0.66 — —
SCHEMBL24624619 0.64 IDO1 (0.40) TDO2IDO1ROCK2
SCHEMBL30613205 0.63 IDO1 (0.35) TDO2IDO1
SCHEMBL14793896 0.62 TDO2 (0.44) TDO2IDO1
SCHEMBL22373976 0.62 TDO2 (0.50) TDO2IDO1ROCK2

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-2982676-B1 Benzimidazo[2,1-B]benzoxazoles for electronic applications IDEMITSU KOSAN CO (JP) 2018-04-11 — — EP disclosed
EP-3063153-B1 AZADIBENZOTHIOPHENES FOR ELECTRONIC APPLICATIONS IDEMITSU KOSAN CO (JP) 2018-03-07 — — EP disclosed
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