SCHEMBL19309592

SCHEMBL19309592

C1=Cc2oc3cnccc3c2C=CN=1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 11/20 0.33
▸ TDO2 P48775 15/20 0.33
▸ 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
SCHEMBL26425197 0.80 HASPIN (0.37) —
SCHEMBL19309810 0.69 KDM4E (0.31) —
SCHEMBL19937653 0.68 TDO2 (0.38) IDO1TDO2ROCK2
SCHEMBL21315928 0.68 TDO2 (0.35) IDO1TDO2
SCHEMBL19257399 0.68 TDO2 (0.35) IDO1TDO2ROCK2
SCHEMBL11885001 0.68 IDO1 (0.46) IDO1TDO2ROCK2
SCHEMBL26425778 0.67 EGFR (0.33) —
SCHEMBL22104644 0.65 — —
SCHEMBL30613205 0.63 IDO1 (0.35) IDO1TDO2
SCHEMBL11884994 0.61 IDO1 (0.41) IDO1TDO2ROCK2

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-9755159-B2 Organic materials for OLEDs UNIVERSAL DISPLAY CORPORATION (US) 2017-09-05 — — US disclosed
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