SCHEMBL7864534

SCHEMBL7864534

CCCCC(C)COC(=O)c1ccc(C(=O)OCC(C)CCCC)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.61
ALDH1A1 P00352 6/20 0.57
LMNA P02545 6/20 0.57
CYP3A4 P08684 4/20 0.57
HSD17B10 Q99714 1/20 0.57
TSHR P16473 4/20 0.54
MAPK1 P28482 2/20 0.54
CYP1A2 P05177 3/20 0.51
ESR1 P03372 3/20 0.51
CYP2C19 P33261 2/20 0.51
CYP2D6 P10635 1/20 0.51
NR1H2 P55055 1/20 0.51
RNASEL Q05823 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP2C9 P11712 1/20 0.50
PDE4D Q08499 1/20 0.50
CA2 P00918 2/20 0.49
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
CHRM1 P11229 1/20 0.46

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
SCHEMBL8956804 0.95 MAPT (0.56) MAPTALDH1A1LMNACYP3A4HSD17B10
SCHEMBL5373240 0.95 MAPT (0.59) MAPTALDH1A1LMNACYP3A4HSD17B10
SCHEMBL28411160 0.93 MAPT (0.58) MAPTALDH1A1LMNACYP3A4HSD17B10
SCHEMBL28875159 0.92 MAPT (0.56) MAPTALDH1A1LMNACYP3A4HSD17B10
SCHEMBL26185708 0.89 MAPT (0.65) MAPTALDH1A1LMNACYP3A4HSD17B10
SCHEMBL21143389 0.86 MAPT (0.57) MAPTALDH1A1LMNACYP3A4HSD17B10
SCHEMBL30437460 0.86 PRSS1 (0.55) MAPTALDH1A1LMNACYP3A4HSD17B10
SCHEMBL18917312 0.86 PRSS1 (0.55) MAPTALDH1A1LMNACYP3A4HSD17B10
SCHEMBL8956968 0.85 MAPT (0.59) MAPTALDH1A1LMNACYP3A4HSD17B10
SCHEMBL23607740 0.85 ALDH1A1 (0.71) MAPTALDH1A1LMNACYP3A4HSD17B10

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
EP-0811639-B1 SOLID CATALYTIC COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST TOHO TITANIUM CO LTD (JP) 2001-08-01 EP disclosed
US-5965478-A A POLYMERIZATION CATALYST IS A REACTION PRODUCT OF A TITANIUM HALIDE, A DIESTER OF AROMATIC DICARBOXYLIC ACID AND A DIALKOXYMAGNESIUM PARTICLES HAVING A HIGH BULK DENSITY; POLYOLEFIN HAVING A HIGH STEREOREGULARITY, HIGH BULK DENSITY TOHO TITANIUM CO., LTD. (JP) 1999-10-12 US disclosed
EP-0811639-A1 SOLID CATALYTIC COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST TOHO TITANIUM CO., LTD. (JP) 1997-12-10 EP disclosed