SCHEMBL7532413

SCHEMBL7532413

[c]1cc(Cc2ccccc2)ccc1Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.52
LTA4H P09960 7/20 0.42
IDH1 O75874 1/20 0.41
PLA2G10 O15496 1/20 0.39
PLA2G2A P14555 1/20 0.39
LMNA P02545 1/20 0.39
SLC22A2 O15244 1/20 0.38
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CYP2C9 P11712 1/20 0.35
HNF4A P41235 1/20 0.35
BCL2 P10415 1/20 0.34
BCL2L1 Q07817 1/20 0.34

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
SCHEMBL27996389 0.86 LOXL2 (0.48) CALM1LTA4HIDH1PLA2G10PLA2G2A
SCHEMBL28149724 0.79 CALM1 (0.42) CALM1LTA4HIDH1LMNA
SCHEMBL27561411 0.79 CALM1 (0.42) CALM1LTA4HBCL2BCL2L1
SCHEMBL1196532 0.79 CALM1 (0.42) CALM1LMNA
SCHEMBL7476751 0.78 CALM1 (0.52) CALM1LTA4HIDH1PLA2G10PLA2G2A
SCHEMBL20270475 0.77 CALM1 (0.50) CALM1LTA4HIDH1PLA2G10PLA2G2A
SCHEMBL8094422 0.75 CALM1 (0.92) CALM1LTA4HIDH1PLA2G10PLA2G2A
SCHEMBL972712 0.75 CALM1 (0.92) CALM1LTA4HIDH1PLA2G10PLA2G2A
SCHEMBL28913652 0.75 LTA4H (0.58) CALM1LTA4HIDH1
SCHEMBL79754 0.73 CALM1 (0.50) CALM1LTA4HIDH1PLA2G10PLA2G2A

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
WO-2002020448-A1 PROCESS FOR THE HYDROFORMYLATION OF ALKENES DYNEA CHEMICALS OY (FI) 2002-03-14 WO claimed
US-20120184693-A1 ETHYLENE POLYMER PREPARATION METHOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-19 US disclosed
WO-2002020448-A1 PROCESS FOR THE HYDROFORMYLATION OF ALKENES DYNEA CHEMICALS OY (FI) 2002-03-14 WO disclosed