SCHEMBL31420488

SCHEMBL31420488

OCCCCNc1ncccc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
SYK P43405 3/20 0.43
FLT3 P36888 4/20 0.42
TYRO3 Q06418 4/20 0.42
MERTK Q12866 4/20 0.42
AXL P30530 4/20 0.42
GAS6 Q14393 3/20 0.42
PDE5A O76074 1/20 0.40
HIF1A Q16665 1/20 0.39
KCNH3 Q9ULD8 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL26686723 1.00 KDM4E (0.46) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL29882733 0.88 KDM4E (0.47) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL18356238 0.88 KDM4E (0.47) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL11666495 0.83 UTS2R (0.48) KDM4ELMNASMN1; SMN2SYKFLT3
SCHEMBL7479010 0.81 TLR8 (0.51) KDM4ELMNASMN1; SMN2SYKFLT3
SCHEMBL7053935 0.81 KDM4E (0.47) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL13931357 0.77 SYK (0.46) KDM4EMAPTSYKALDH1A1HPGD
SCHEMBL7464659 0.77 ALDH1A1 (0.55) KDM4EHTTSYKPDE5AALDH1A1
SCHEMBL7052357 0.76 ALDH1A1 (0.44) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL1978099 0.76 HIF1A (0.44) KDM4EMAPTLMNAHTTKMT2A

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-119562945-A IKK inhibitors 癌症研究技术有限公司 2025-03-04 CN disclosed