SCHEMBL9330107

SCHEMBL9330107

CCCCOc1ccc(OC(=O)c2ccc(OC3CCCCO3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
MEN1 O00255 1/20 0.57
LMNA P02545 4/20 0.53
NPC1 O15118 3/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
PRSS1 P07477 1/20 0.53
ACR P10323 1/20 0.53
NFKB1 P19838 3/20 0.52
NFKB2 Q00653 3/20 0.52
RELA Q04206 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPT P10636 2/20 0.49
POLB P06746 2/20 0.46
TSHR P16473 2/20 0.46
RAB9A P51151 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL11219164 0.89 SMN1; SMN2 (0.44) KMT2AMEN1LMNANPC1CYP1A2
SCHEMBL1531938 0.85 KMT2A (0.78) KMT2AMEN1LMNANPC1CYP1A2
SCHEMBL12768363 0.85 KMT2A (0.78) KMT2AMEN1LMNANPC1CYP1A2
SCHEMBL16073032 0.84 ACR (0.48) KMT2AMEN1LMNANPC1PRSS1
SCHEMBL431821 0.84 MEN1 (0.50) KMT2AMEN1LMNANPC1CYP1A2
SCHEMBL433236 0.84 MEN1 (0.53) KMT2AMEN1LMNANPC1CYP1A2
SCHEMBL2431457 0.84 KMT2A (0.62) KMT2AMEN1LMNANPC1CYP1A2
SCHEMBL1531901 0.84 CYP2C9 (0.42) KMT2AMEN1LMNANPC1CYP1A2
SCHEMBL1531903 0.84 CYP2C9 (0.42) KMT2AMEN1LMNANPC1CYP1A2
SCHEMBL9669833 0.82 NPC1 (0.51) KMT2AMEN1LMNANPC1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0428542-B1 FERROELECTRIC LIQUID-CRYSTAL POLYMERS CONTAINING Si, PROCESS FOR PRODUCING THE SAME AND THEIR USE IN ELECTRO-OPTICAL ELEMENTS HOECHST AG (DE) 1994-09-07 EP disclosed
EP-0424461-B1 Novel ferroelectric liquid-crystal polymers, process for producing said polymers and their use in electro-optical components HOECHST AG (DE) 1994-04-13 EP disclosed
US-5227090-A Acrylic ester polymers HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-13 US disclosed
EP-0428542-A1 FERROELECTRIC LIQUID-CRYSTAL POLYMERS CONTAINING Si, PROCESS FOR PRODUCING THE SAME AND THEIR USE IN ELECTRO-OPTICAL ELEMENTS. HOECHST AG (DE) 1991-05-29 EP disclosed
EP-0424461-A1 Novel ferroelectric liquid-crystal polymers, process for producing said polymers and their use in electro-optical components. HOECHST AG (DE) 1991-05-02 EP disclosed
WO-1990001505-A1 FERROELECTRIC LIQUID-CRYSTAL POLYMERS CONTAINING Si, PROCESS FOR PRODUCING THE SAME AND THEIR USE IN ELECTRO-OPTICAL ELEMENTS HOECHST AG (DE) 1990-02-22 WO disclosed
WO-1990000587-A1 NOVEL FERROELECTRIC LIQUID-CRYSTAL POLYMERS, PROCESS FOR PRODUCING SAID POLYMERS AND THEIR USE IN ELECTRO-OPTICAL COMPONENTS HOECHST AKTIENGESELLSCHAFT (DE) 1990-01-25 WO disclosed