SCHEMBL5581391

SCHEMBL5581391

CCC(C)(c1cc(C)c(Oc2ccc(C(=O)O)cc2)c(C)c1)c1cc(C)c(Oc2ccc(C(=O)O)cc2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.48
CYP2C9 P11712 1/20 0.48
RAB9A P51151 1/20 0.48
LPAR1 Q92633 4/20 0.47
LPAR5 Q9H1C0 4/20 0.47
RXRA P19793 2/20 0.43
NR4A2 P43354 1/20 0.43
RXRB P28702 1/20 0.43
PARP15 Q460N3 1/20 0.41
PARP10 Q53GL7 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
SRD5A2 P31213 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
KMT2A Q03164 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
AMY1A P0DUB6 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
SCHEMBL5581508 0.86 NPC1 (0.46) NPC1POLBCYP2C9RAB9ARXRA
SCHEMBL5582339 0.85 LPAR1 (0.48) NPC1POLBCYP2C9RAB9ALPAR1
SCHEMBL9460845 0.83 ALDH1A1 (0.44) NPC1POLBCYP2C9RAB9ARXRB
SCHEMBL5581293 0.83 RXRA (0.50) NPC1POLBCYP2C9RAB9ALPAR1
SCHEMBL5581812 0.83 NPC1 (0.57) NPC1POLBCYP2C9RAB9ARXRA
SCHEMBL2846809 0.80 LPAR1 (0.51) LPAR1LPAR5RXRARXRBPARP15
SCHEMBL2895331 0.79 MAPT (0.54) NPC1POLBRAB9AMEN1KMT2A
SCHEMBL5581616 0.79 SRD5A2 (0.57) NPC1POLBRAB9ALPAR1LPAR5
SCHEMBL30498840 0.77 HPGD (0.52) LPAR1LPAR5RXRANR4A2RXRB
SCHEMBL9578939 0.76 MEN1 (0.59) RXRANR4A2RXRBCA1CA2

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-20070148480-A1 Laminate TEIJIN LIMITED (JP) 2007-06-28 US disclosed
EP-1698460-A1 MULTILAYER BODY TEIJIN LIMITED (JP) 2006-09-06 EP disclosed
US-20060134407-A1 Adhesive sheet and layered product TEIJIN LIMITED (JP) 2006-06-22 US disclosed
EP-1589086-A1 ADHESIVE SHEET AND LAYERED PRODUCT TEIJIN LIMITED (JP) 2005-10-26 EP disclosed