SCHEMBL10609883

SCHEMBL10609883

CCCCCCCCCCCCCCCCCCOC(=O)N1CCCC(CO)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA2 Q9HCG7 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.43
POLB P06746 3/20 0.43
LMNA P02545 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
NR1H4 Q96RI1 1/20 0.42
EPHX2 P34913 2/20 0.40
GRM3 Q14832 3/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
NAAA Q02083 1/20 0.38
LIPE Q05469 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
P2RY12 Q9H244 1/20 0.38

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
SCHEMBL10610075 1.00 GBA2 (0.49) GBA2SMN1; SMN2POLBLMNANPC1
SCHEMBL4599962 0.94 SMN1; SMN2 (0.49) GBA2SMN1; SMN2POLBLMNANPC1
SCHEMBL29812927 0.94 SMN1; SMN2 (0.49) GBA2SMN1; SMN2POLBLMNANPC1
SCHEMBL29813031 0.90 SMN1; SMN2 (0.48) GBA2SMN1; SMN2POLBLMNANPC1
SCHEMBL5724467 0.86 LMNA (0.51) GBA2SMN1; SMN2POLBLMNANR1H4
SCHEMBL9285131 0.86 LMNA (0.51) GBA2SMN1; SMN2POLBLMNANR1H4
SCHEMBL8324568 0.85 POLB (0.50) GBA2SMN1; SMN2POLBLMNANR1H4
SCHEMBL5629746 0.84 EPHX2 (0.49) SMN1; SMN2POLBNPC1RAB9ANR1H4
SCHEMBL30678922 0.84 SMN1; SMN2 (0.47) GBA2SMN1; SMN2POLBLMNANPC1
SCHEMBL9760333 0.83 LPAR3 (0.42) GBA2SMN1; SMN2POLBLMNAMEN1

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
EP-0213082-B1 SUBSTITUTED HYDROXY-HETEROCYCLYL-ALKOXY PHOSPHINYLOXY TRIALKYLAMINIUM HYDROXIDE INNER SALT OXIDES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS SANDOZ AG (CH) 1989-10-18 EP disclosed
US-4749696-A ANTICARCINOGENIC AGENT SANDOZ PHARM. CORP. (US) 1988-06-07 US disclosed