SCHEMBL28518633

SCHEMBL28518633

COc1ccc(C(=O)Oc2ccc(OC)c(OC)c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.69
ALDH1A1 P00352 3/20 0.65
GAA P10253 2/20 0.65
RAB9A P51151 2/20 0.61
CASP3 P42574 1/20 0.61
SENP8 Q96LD8 1/20 0.61
SENP7 Q9BQF6 1/20 0.61
SENP6 Q9GZR1 1/20 0.61
MAPT P10636 1/20 0.58
MEN1 O00255 2/20 0.57
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
CA12 O43570 1/20 0.57
CA7 P43166 1/20 0.57
CA9 Q16790 1/20 0.57
CA14 Q9ULX7 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.56
NPC1 O15118 2/20 0.56
LMNA P02545 2/20 0.56
PRSS1 P07477 1/20 0.56

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
SCHEMBL17304613 0.95 KMT2A (0.77) KMT2AALDH1A1GAARAB9ACASP3
SCHEMBL17933739 0.91 MAPT (0.70) KMT2AALDH1A1GAARAB9ACASP3
SCHEMBL28602500 0.90 MAPT (0.68) KMT2AALDH1A1GAARAB9ACASP3
SCHEMBL17933786 0.90 KMT2A (0.69) KMT2AALDH1A1RAB9AMAPTCA1
SCHEMBL17301259 0.89 KMT2A (0.69) KMT2AALDH1A1GAARAB9ACASP3
SCHEMBL10436239 0.88 KMT2A (0.60) KMT2AALDH1A1GAARAB9AMAPT
SCHEMBL19623998 0.85 KMT2A (0.64) KMT2AALDH1A1RAB9AMAPTNPC1
SCHEMBL10039541 0.85 KMT2A (0.64) KMT2AALDH1A1GAARAB9AMAPT
SCHEMBL17301260 0.85 KMT2A (0.64) KMT2AALDH1A1GAARAB9AMAPT
SCHEMBL14451171 0.85 KMT2A (0.60) KMT2AALDH1A1GAARAB9ACASP3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112375168-B Side chain rod-shaped polar liquid crystal polymer, preparation method thereof and application thereof in nonlinear optical field 华南理工大学 2022-03-29 CN disclosed
CN-112375168-A Side chain rod-shaped polar liquid crystal polymer, preparation method thereof and application thereof in nonlinear optical field 华南理工大学 2021-02-19 CN disclosed
CN-112342032-A Rod-like polar liquid crystal molecule, preparation method thereof and rod-like polar nematic liquid crystal 华南理工大学 2021-02-09 CN disclosed