SCHEMBL31464865

SCHEMBL31464865

Oc1ccc2c(c1)OCc1c-2oc2cc(O)ccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.60
MAPT P10636 3/20 0.60
ALOX15 P16050 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
MEN1 O00255 2/20 0.60
CYP3A4 P08684 2/20 0.60
KMT2A Q03164 2/20 0.60
USP2 O75604 1/20 0.60
ESRRB O95718 7/20 0.48
ESRRA P11474 7/20 0.48
PTPN1 P18031 1/20 0.47
ALDH1A1 P00352 3/20 0.46
HSD17B10 Q99714 3/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
HPGD P15428 2/20 0.43
CASP1 P29466 2/20 0.43
CASP7 P55210 2/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL4742427 1.00 KDM4E (0.60) KDM4EMAPTALOX15SMN1; SMN2MEN1
SCHEMBL29747120 0.88 MEN1 (0.51) KDM4EMAPTALOX15SMN1; SMN2MEN1
SCHEMBL19369562 0.88 MEN1 (0.51) KDM4EMAPTALOX15SMN1; SMN2MEN1
SCHEMBL3936675 0.88 ESRRB (0.51) KDM4EMAPTALOX15SMN1; SMN2MEN1
SCHEMBL13958281 0.82 MAPT (0.48) KDM4EMAPTALOX15SMN1; SMN2MEN1
SCHEMBL5112338 0.80 KDM4E (0.52) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL31253969 0.80 KDM4E (0.46) KDM4EMAPTALOX15SMN1; SMN2MEN1
SCHEMBL3924574 0.76 ESRRB (0.49) KDM4EMAPTALOX15SMN1; SMN2MEN1
Dehydrovariabilin SCHEMBL13657398 0.75 MAPT (1.00) KDM4EMAPTALOX15SMN1; SMN2MEN1
Dehydrovariabilin SCHEMBL31368572 0.75 MAPT (1.00) KDM4EMAPTALOX15SMN1; SMN2MEN1

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-117462690-B Pharmaceutical composition and application thereof 中南林业科技大学 2025-03-21 CN disclosed