SCHEMBL5604103

SCHEMBL5604103

CCCCCCOC(=O)C1=CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
TSHR P16473 2/20 0.50
LMNA P02545 2/20 0.50
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPK1 P28482 1/20 0.47
ESR1 P03372 3/20 0.47
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
AKR1C4 P17516 1/20 0.47
AKR1C3 P42330 1/20 0.47
AKR1C2 P52895 1/20 0.47
AKR1C1 Q04828 1/20 0.47
KDM4E B2RXH2 1/20 0.44
POLB P06746 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
SCHEMBL810728 1.00 ALDH1A1 (0.50) ALDH1A1TSHRLMNATP53CYP3A4
SCHEMBL1185177 1.00 ALDH1A1 (0.50) ALDH1A1TSHRLMNATP53CYP3A4
SCHEMBL1976767 0.98 ALDH1A1 (0.49) ALDH1A1TSHRLMNATP53CYP3A4
SCHEMBL10620678 0.95 ALDH1A1 (0.51) ALDH1A1TSHRLMNATP53CYP3A4
SCHEMBL313419 0.94 TSHR (0.47) ALDH1A1TSHRLMNATP53CYP3A4
SCHEMBL20994214 0.94 TSHR (0.50) ALDH1A1TSHRLMNATP53CYP3A4
SCHEMBL9443741 0.92 TSHR (0.46) ALDH1A1TSHRLMNATP53CYP3A4
SCHEMBL678651 0.89 TSHR (0.49) ALDH1A1TSHRLMNATP53CYP3A4
SCHEMBL15522251 0.87 ALDH1A1 (0.44) ALDH1A1TSHRLMNAESR1MAPT
SCHEMBL5073738 0.87 ALDH1A1 (0.56) ALDH1A1TSHRLMNATP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7160949-B2 Olefin block copolymers, processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-01-09 US disclosed
EP-1275670-B1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF MITSUI CHEMICALS INC (JP) 2005-08-10 EP disclosed
US-20030055179-A1 Olefin block copolymers processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2003-03-20 US disclosed
EP-1275670-A1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2003-01-15 EP disclosed