SCHEMBL9762480

SCHEMBL9762480

CCCCn1c2ccccc2c2cc(C(=O)C(O)C(O)C(=O)c3ccc4c(c3)c3ccccc3n4CCCC)ccc21

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 17/20 0.66
ALDH1A1 P00352 1/20 0.62
HPGD P15428 1/20 0.62
NPC1 O15118 2/20 0.61
CNR1 P21554 1/20 0.60

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
SCHEMBL27918668 0.85 CNR2 (0.70) CNR2ALDH1A1HPGDNPC1CNR1
SCHEMBL28050802 0.82 CNR2 (0.77) CNR2ALDH1A1HPGDNPC1CNR1
SCHEMBL600012 0.82 ALDH1A1 (0.82) CNR2ALDH1A1HPGDNPC1CNR1
SCHEMBL30475136 0.81 CNR2 (0.65) CNR2ALDH1A1HPGDNPC1CNR1
SCHEMBL28394599 0.81 CNR2 (0.75) CNR2ALDH1A1HPGDNPC1CNR1
SCHEMBL28225833 0.81 ALDH1A1 (0.80) CNR2ALDH1A1HPGDNPC1CNR1
SCHEMBL28050803 0.81 CNR2 (0.75) CNR2ALDH1A1HPGDNPC1CNR1
SCHEMBL28386085 0.81 CNR2 (0.75) CNR2ALDH1A1HPGDNPC1CNR1
SCHEMBL27832072 0.81 CNR2 (0.75) CNR2ALDH1A1HPGDNPC1CNR1
SCHEMBL28053878 0.81 CNR2 (0.75) CNR2ALDH1A1HPGDNPC1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5071888-A Storage stability ASAHI DENKA KOGYO K.K. (JP) 1991-12-10 US disclosed
EP-0171600-A1 Carbazole photoinitiators for the photopolymerization of unsaturated compounds ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1986-02-19 EP disclosed