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SCHEMBL31479904

SCHEMBL31479904

CC(C)N(CC(F)F)C(=O)c1cc(F)ccc1-c1cc(C2CCN(CCN3CCC(NC(=O)OC(C)(C)C)CC3)C2)cc2c1cnn2C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CCR5 P51681 1/20 0.37
▸ CCNT1 O60563 1/20 0.36
▸ CDK9 P50750 1/20 0.36
▸ TP53 P04637 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ NPY5R Q15761 4/20 0.34
▸ NTRK1 P04629 3/20 0.34
▸ KCNA3 P22001 1/20 0.34
▸ PARP1 P09874 1/20 0.34
▸ ATM Q13315 1/20 0.33
▸ PLK1 P53350 1/20 0.33

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
SCHEMBL31479620 1.00 CCR5 (0.37) CCR5CCNT1CDK9TP53LMNA
SCHEMBL31479903 1.00 CCR5 (0.37) CCR5CCNT1CDK9TP53LMNA
SCHEMBL31479757 0.91 KDM4D (0.33) CCR5CCNT1CDK9TP53LMNA
SCHEMBL31479428 0.91 KDM4D (0.33) CCR5CCNT1CDK9TP53LMNA
SCHEMBL31479539 0.88 TRPV1 (0.33) CCR5CCNT1CDK9TP53LMNA
SCHEMBL31479136 0.88 GPR119 (0.39) CCNT1CDK9TP53
SCHEMBL31479066 0.88 GPR119 (0.39) CCNT1CDK9TP53
SCHEMBL31479646 0.88 GPR119 (0.39) CCNT1CDK9TP53
SCHEMBL31479405 0.86 GPBAR1 (0.41) CCNT1CDK9TP53PLK1
SCHEMBL31479791 0.86 ALOX5AP (0.39) —

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-2025067111-A1 MENIN-MLL INTERACTION INHIBITOR AND PREPARATION METHOD THEREFOR, AND APPLICATION 苏州必扬医药科技有限公司 2025-04-03 — — WO disclosed