SCHEMBL7920489

SCHEMBL7920489

CCCC(C)(CC)C(C)(C(=O)O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
FFAR3 O14843 2/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
GGT1 P19440 1/20 0.31
FDPS P14324 1/20 0.31
ARG1 P05089 1/20 0.31

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
SCHEMBL16143873 0.80 ALDH1A1 (0.35) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL7640876 0.78 ALDH1A1 (0.34) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL905441 0.78 ALDH1A1 (0.34) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL31462325 0.78 ALDH1A1 (0.34) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL31462328 0.78 ALDH1A1 (0.34) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL28658097 0.77 LMNA (0.40) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL9930215 0.76 ALDH1A1 (0.33) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL14613986 0.75 ALDH1A1 (0.35) ALDH1A1MEN1CYP1A2THRBKMT2A
Acetic Acid SCHEMBL27828042 0.73 FFAR3 (0.33) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL2220954 0.73 CYP2C19 (0.43) ALDH1A1MEN1CYP1A2THRBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920461-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL TECHNOLOGY CO BV (NL) 2001-10-17 EP claimed
US-6281301-B1 COORDINATION CATALYST MONTELL TECHNOLOGY COMPANY BV (NL) 2001-08-28 US claimed
EP-0920461-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Montell Technology Company bv (NL) 1999-06-09 EP claimed
WO-1998056834-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-12-17 WO claimed
EP-0920461-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL TECHNOLOGY CO BV (NL) 2001-10-17 EP disclosed
US-6281301-B1 COORDINATION CATALYST MONTELL TECHNOLOGY COMPANY BV (NL) 2001-08-28 US disclosed
EP-0920461-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Montell Technology Company bv (NL) 1999-06-09 EP disclosed
WO-1998056834-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-12-17 WO disclosed