SCHEMBL9715716

SCHEMBL9715716

C=C(C(=C)c1cccc(OC)c1OC)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
LMNA P02545 2/20 0.46
ALDH1A1 P00352 2/20 0.46
GAA P10253 2/20 0.46
NPC1 O15118 5/20 0.46
RAB9A P51151 4/20 0.46
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
USP2 O75604 1/20 0.43
POLB P06746 2/20 0.42
HTT P42858 2/20 0.42
NFE2L2 Q16236 1/20 0.41
KCNK3 O14649 1/20 0.41
KCNK9 Q9NPC2 1/20 0.41
HPGD P15428 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL9715772 0.86 RAB9A (0.53) KMT2ALMNAALDH1A1NPC1RAB9A
SCHEMBL8502908 0.81 NPC1 (0.50) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL29503038 0.81 NPC1 (0.50) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL10321909 0.81 KMT2A (0.50) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL7928651 0.80 KMT2A (0.53) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL11050111 0.78 KMT2A (0.55) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL5311864 0.78 KMT2A (0.47) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL322169 0.78 MAPT (0.57) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL29986971 0.78 MAPT (0.57) KMT2AMEN1LMNAALDH1A1GAA
SCHEMBL870485 0.77 NPC1 (0.52) KMT2AMEN1LMNAALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0311689-B1 PROCESS FOR SELECTIVELY MONOHYDROFORMYLATING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-06-10 EP disclosed
EP-0304495-B1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-05-27 EP disclosed
US-4982007-A CARBONYLATION CATALYST NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-01-01 US disclosed
US-4908473-A Reacting a (1-arylethenyl)vinylbenzene with carbon monoxide and water or alcohol in the presence of carbonylation catalyst NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-03-13 US disclosed
EP-0311689-A1 PROCESS FOR SELECTIVELY MONOHYDROFORMYLATING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-04-19 EP disclosed
EP-0304495-A1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-03-01 EP disclosed