SCHEMBL22944175

SCHEMBL22944175

CC(C)(C)OC(=O)N1CCOC(COc2cc(Cl)nnc2Cl)C1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 8/20 0.52
▸ EPHB4 P54760 2/20 0.52
▸ ERBB2 P04626 1/20 0.52
▸ P2RX3 P56373 3/20 0.41
▸ P2RX2 Q9UBL9 3/20 0.41
▸ BUB1 O43683 1/20 0.41
▸ KDR P35968 3/20 0.41
▸ RET P07949 2/20 0.40
▸ NR1H4 Q96RI1 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ MALT1 Q9UDY8 1/20 0.39
▸ GPR119 Q8TDV5 1/20 0.38
▸ SCN9A Q15858 1/20 0.37

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
SCHEMBL22944176 0.84 EPHA2 (0.48) EPHA2EPHB4ERBB2P2RX3P2RX2
SCHEMBL29578573 0.84 EPHA2 (0.48) EPHA2EPHB4ERBB2P2RX3P2RX2
SCHEMBL20241598 0.84 EPHA2 (0.49) EPHA2EPHB4ERBB2P2RX3P2RX2
SCHEMBL22943840 0.83 EPHA2 (0.48) EPHA2EPHB4ERBB2P2RX3P2RX2
SCHEMBL29578513 0.83 EPHA2 (0.48) EPHA2EPHB4ERBB2P2RX3P2RX2
SCHEMBL20241498 0.82 EPHA2 (0.50) EPHA2EPHB4ERBB2P2RX3P2RX2
SCHEMBL29827125 0.82 EPHA2 (0.51) EPHA2EPHB4ERBB2P2RX3P2RX2
SCHEMBL22943252 0.81 EPHA2 (0.44) EPHA2EPHB4ERBB2P2RX3P2RX2
SCHEMBL4510923 0.81 EPHA2 (0.54) EPHA2EPHB4ERBB2RETNR1H4
SCHEMBL20242070 0.80 EPHA2 (0.51) EPHA2EPHB4ERBB2P2RX3P2RX2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114728949-A Heterocyclic compounds as kinase inhibitors and uses thereof 整体生物科学私人有限公司 2022-07-08 — — CN disclosed
EP-4007757-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITOR AND USES THEREOF Integral Biosciences Pvt. Ltd. (IN) 2022-06-08 — — EP disclosed
WO-2021019514-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITOR AND USES THEREOF INTEGRAL BIOSCIENCES PVT. LTD. (IN) 2021-02-04 — — WO disclosed
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