SCHEMBL23763558

CC(C)(C)c1ccc2c(c1)nc1n2c2c3c4ccccc4n4c3c(c3c5ccccc5n1c32)n1c2ccc(C(C)(C)CCC(C)(C)c3cccc5c3nc3n5c5c6c7cc(C(C)(C)C)ccc7n7c6c(c6c8cc(C(C)(C)C)ccc8n3c65)n3c5cccc(C(C)(C)C)c5nc37)cc2nc14

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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.

Compound	similarity	top predicted	shared targets
SCHEMBL23763561	0.85	PGR (0.30)	—
SCHEMBL23763473	0.80	GABRP (0.33)	—
SCHEMBL23763557	0.79	HTR1D (0.34)	—
SCHEMBL23763499	0.78	ALDH1A1 (0.39)	—
SCHEMBL23763512	0.76	—	—
SCHEMBL23763628	0.74	PTGER4 (0.34)	—
SCHEMBL23763732	0.73	HTR1D (0.31)	—
SCHEMBL23763425	0.73	NR1H4 (0.38)	—
SCHEMBL23763733	0.73	PLK4 (0.36)	—
SCHEMBL23763731	0.71	HTR1D (0.33)	—

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-3865486-A1	HETEROCYCLIC COMPOUND AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE HETEROCYCLIC COMPOUND	IDEMITSU KOSAN CO., LTD. (JP)	2021-08-18	—	—	EP	disclosed