SCHEMBL31330786

SCHEMBL31330786

C=Cc1cc(F)c(F)cc1C(=O)N(CC)CC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 4/20 0.39
HSP90AB1 P08238 4/20 0.39
HPGD P15428 4/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.36
COMT P21964 1/20 0.36
MLYCD O95822 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
RECQL P46063 1/20 0.35
KEAP1 Q14145 1/20 0.35
ALPL P05186 1/20 0.35
KDM4E B2RXH2 2/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL31330707 0.85 ERN1 (0.42) HSP90AA1HSP90AB1HPGDTSHRCOMT
SCHEMBL25141414 0.84 KDM4E (0.42) HSP90AA1HSP90AB1HPGDCYP1A2CYP3A4
SCHEMBL2334415 0.76 HPGD (0.46) HSP90AA1HSP90AB1HPGDTSHRCOMT
SCHEMBL7280352 0.75 KEAP1 (0.49) HSP90AA1HSP90AB1HPGDCYP1A2CYP3A4
SCHEMBL7294976 0.71 HPGD (0.40) HSP90AA1HSP90AB1HPGDTSHRCOMT
SCHEMBL7305124 0.71 HPGD (0.40) HSP90AA1HSP90AB1HPGDTSHRCOMT
SCHEMBL7421174 0.71 HPGD (0.40) HSP90AA1HSP90AB1HPGDTSHRCOMT
SCHEMBL31306166 0.70 CA12 (0.38) HPGDHSD17B10TSHRTDP1LMNA
SCHEMBL15221196 0.69 ERN1 (0.42) HSP90AA1HSP90AB1HPGDMLYCDTDP1
SCHEMBL7218207 0.69 CES2 (0.55) HSP90AA1HSP90AB1HPGDTSHRMLYCD

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-2025011623-A1 CYANOQUINOLINE-TARGETING PROTEIN DEGRADATION MOLECULE, PREPARATION METHOD THEREFOR AND USE THEREOF 上海壹迪生物技术有限公司 2025-01-16 WO disclosed