SCHEMBL11065373

SCHEMBL11065373

CCCCCCN1CCN(Cc2ccc(NC(C)C)cc2)C(=O)C1=O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 8/20 0.55
TP53 P04637 3/20 0.38
LMNA P02545 2/20 0.36
S1PR1 P21453 1/20 0.36
P2RX7 Q99572 1/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35
SPHK2 Q9NRA0 3/20 0.34
SPHK1 Q9NYA1 3/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 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
SCHEMBL11044784 0.85 PLA2G2A (0.57) PLA2G2ATP53LMNAS1PR1P2RX7
SCHEMBL11045671 0.84 PLA2G2A (0.56) PLA2G2ALMNAPOLBHPGDRAB9A
SCHEMBL11065378 0.84 PLA2G2A (0.56) PLA2G2ATP53LMNAS1PR1P2RX7
SCHEMBL11047702 0.80 PLA2G2A (0.60) PLA2G2ALMNAS1PR1P2RX7
SCHEMBL11051562 0.80 PLA2G2A (0.54) PLA2G2ALMNAS1PR1POLBSPHK1
SCHEMBL11047743 0.79 PLA2G2A (0.53) PLA2G2AS1PR1
SCHEMBL11047681 0.79 PLA2G2A (0.56) PLA2G2ATP53LMNAS1PR1P2RX7
SCHEMBL11045600 0.76 PLA2G2A (0.56) PLA2G2ALMNANPC1RAB9A
SCHEMBL11047656 0.75 PLA2G2A (0.50) PLA2G2AHPGD
SCHEMBL11049739 0.74 PLA2G2A (0.54) PLA2G2ATP53LMNAS1PR1P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4477666-A ANTICARCINO GENIC AGENTS TOYAMA CHEMICAL CO., LTD. (JP) 1984-10-16 US claimed