SCHEMBL14679430

SCHEMBL14679430

COc1ccc(C(=O)Oc2ccc3cc(OC(=O)c4ccc(O)cc4)ccc3c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.63
▸ MEN1 O00255 5/20 0.63
▸ CASP3 P42574 1/20 0.63
▸ SENP8 Q96LD8 1/20 0.63
▸ SENP7 Q9BQF6 1/20 0.63
▸ SENP6 Q9GZR1 1/20 0.63
▸ GBA1 P04062 1/20 0.61
▸ ESR2 Q92731 2/20 0.56
▸ MAPT P10636 4/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ CA1 P00915 2/20 0.55
▸ CA2 P00918 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ LMNA P02545 1/20 0.54
▸ CYP1A2 P05177 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ ESR1 P03372 3/20 0.54

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
SCHEMBL12608605 0.93 GBA1 (0.68) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL777824 0.91 KMT2A (0.65) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL16550074 0.90 SMN1; SMN2 (0.66) KMT2AMEN1ESR2MAPTCA1
SCHEMBL7861539 0.90 SMN1; SMN2 (0.66) KMT2AMEN1ESR2MAPTCA1
SCHEMBL13822043 0.90 SMN1; SMN2 (0.66) KMT2AMEN1ESR2MAPTCA1
SCHEMBL18121569 0.90 SMN1; SMN2 (0.66) KMT2AMEN1ESR2MAPTCA1
SCHEMBL9683108 0.90 SMN1; SMN2 (0.66) KMT2AMEN1ESR2MAPTCA1
SCHEMBL18607968 0.89 ESR2 (0.63) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL11297653 0.88 KMT2A (0.61) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL8756308 0.88 KMT2A (0.61) KMT2AMEN1CASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8425988-B2 Polymerizable liquid crystal compound, polymerizable liquid crystal composition and anisotropic polymer JNC CORPORATION (JP) 2013-04-23 — — US disclosed
US-8366962-B2 Polymerizable liquid crystal compounds having oxiranyl group, polymerizable liquid crystal compositions and polymers JNC CORPORATION (JP) 2013-02-05 — — US disclosed
Send feedback