SCHEMBL5090331

SCHEMBL5090331

CCCCCCCCCCOc1cc(CN)cc(OCCCCCCCCCC)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.54
TSHR P16473 2/20 0.50
BLM P54132 1/20 0.47
NR5A1 Q13285 1/20 0.47
CNR1 P21554 7/20 0.44
CNR2 P34972 6/20 0.44
TP53 P04637 2/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
RAB9A P51151 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GGPS1 O95749 1/20 0.42

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
SCHEMBL13836862 1.00 PLA2G2A (0.54) PLA2G2ATSHRBLMNR5A1CNR1
SCHEMBL5095048 1.00 PLA2G2A (0.54) PLA2G2ATSHRBLMNR5A1CNR1
SCHEMBL31406517 1.00 PLA2G2A (0.54) PLA2G2ATSHRBLMNR5A1CNR1
SCHEMBL5090437 1.00 PLA2G2A (0.54) PLA2G2ATSHRBLMNR5A1CNR1
SCHEMBL5088868 1.00 PLA2G2A (0.54) PLA2G2ATSHRBLMNR5A1CNR1
SCHEMBL31406472 1.00 PLA2G2A (0.54) PLA2G2ATSHRBLMNR5A1CNR1
SCHEMBL31406505 1.00 PLA2G2A (0.54) PLA2G2ATSHRBLMNR5A1CNR1
SCHEMBL11694989 1.00 PLA2G2A (0.54) PLA2G2ATSHRBLMNR5A1CNR1
SCHEMBL11920200 0.92 PLA2G2A (0.44) PLA2G2ATSHRNR5A1CNR1CNR2
SCHEMBL29313102 0.90 PLA2G2A (0.45) PLA2G2ATSHRBLMNR5A1CNR1

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
CN-119233964-A Single component delivery system for nucleic acids 宾夕法尼亚大学理事会 2024-12-31 CN disclosed
US-7332529-B2 Thermoreversible organogelators, compositions and methods of making thereof CARR ANDREW J 2008-02-19 US disclosed
US-20060089416-A1 Thermoreversible organogelators, compositions and methods of making thereof NORTH PASS VENTURES. 2006-04-27 US disclosed