SCHEMBL27122153

SCHEMBL27122153

CCN(CC)C(=O)c1nn(-c2cc(Cl)cc(Cl)c2)c2c1CCc1cc(OC)c(-c3cncc(C(N)=O)c3)cc1-2

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.40
▸ IKBKB O14920 13/20 0.35
▸ CCNA2 P20248 4/20 0.34
▸ CDK2 P24941 4/20 0.34
▸ CCNA1 P78396 4/20 0.34
▸ CHUK O15111 1/20 0.32
▸ AURKA O14965 1/20 0.32
▸ TTK P33981 1/20 0.32
▸ PLK1 P53350 1/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ MKNK1 Q9BUB5 1/20 0.32
▸ MKNK2 Q9HBH9 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
SCHEMBL27120632 0.94 RAD52 (0.39) RAD52IKBKBCCNA2CDK2CCNA1
SCHEMBL27122203 0.93 RAD52 (0.38) RAD52IKBKBCCNA2CDK2CCNA1
SCHEMBL27122870 0.92 RAD52 (0.36) RAD52IKBKBCCNA2CDK2CCNA1
SCHEMBL30759625 0.90 PDE7A (0.36) RAD52IKBKBCCNA2CDK2CCNA1
SCHEMBL27119776 0.90 PDE7A (0.36) RAD52IKBKBCCNA2CDK2CCNA1
SCHEMBL30759553 0.90 CCNA2 (0.38) RAD52IKBKBCCNA2CDK2CCNA1
SCHEMBL27119960 0.90 CCNA2 (0.38) RAD52IKBKBCCNA2CDK2CCNA1
SCHEMBL27122174 0.89 RAD52 (0.36) RAD52IKBKBCCNA2CDK2CCNA1
SCHEMBL30759674 0.89 CCNA2 (0.42) RAD52IKBKBCCNA2CDK2CCNA1
SCHEMBL27120495 0.89 CCNA2 (0.42) RAD52IKBKBCCNA2CDK2CCNA1

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
WO-2024044778-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-02-29 — — WO disclosed
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