SCHEMBL30790693

SCHEMBL30790693

NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 10/20 0.43
KDR P35968 2/20 0.37
TBK1 Q9UHD2 9/20 0.37
IKBKE Q14164 2/20 0.37
LRRK2 Q5S007 1/20 0.36
KCNH2 Q12809 1/20 0.35

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
SCHEMBL16040024 1.00 SYK (0.43) SYKKDRTBK1IKBKELRRK2
SCHEMBL16038633 1.00 SYK (0.43) SYKKDRTBK1IKBKELRRK2
SCHEMBL29578990 1.00 SYK (0.43) SYKKDRTBK1IKBKELRRK2
SCHEMBL17750250 0.89 SYK (0.39) SYKKDRTBK1IKBKEKCNH2
SCHEMBL17750235 0.88 SYK (0.50) SYKKDRTBK1IKBKELRRK2
SCHEMBL16040973 0.87 SYK (0.38) SYKKDRTBK1IKBKELRRK2
SCHEMBL16040412 0.87 SYK (0.38) SYKKDRTBK1IKBKELRRK2
SCHEMBL16040414 0.87 SYK (0.38) SYKKDRTBK1IKBKELRRK2
SCHEMBL17750256 0.86 PRKDC (0.44) SYKKDRTBK1IKBKE
SCHEMBL17750498 0.85 TBK1 (0.39) SYKKDRTBK1IKBKELRRK2

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
CN-111741955-B DNA-PK inhibitors 沃泰克斯药物股份有限公司 2024-02-23 CN disclosed