SCHEMBL8304295

SCHEMBL8304295

Nc1ccc2nc(C3CCC(=O)O3)sc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.43
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
GFER P55789 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
MAPT P10636 12/20 0.41
GAA P10253 5/20 0.41
KDM4E B2RXH2 3/20 0.41
GLA P06280 3/20 0.41
KEAP1 Q14145 1/20 0.40
ALDH1A1 P00352 4/20 0.40
PKM P14618 2/20 0.40
HPGD P15428 2/20 0.40
TP53 P04637 2/20 0.39
POLB P06746 1/20 0.39
PTBP1 P26599 1/20 0.39

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
SCHEMBL3851706 1.00 SMN1; SMN2 (0.43) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL3847047 0.84 APP (0.36) MEN1KMT2AMAPTAPP
SCHEMBL8308552 0.83 ALDH1A1 (0.50) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL8304507 0.81 KMT2A (0.49) SMN1; SMN2MEN1KMT2AGAAKDM4E
SCHEMBL22201585 0.75 SMN1; SMN2 (0.54) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL8303658 0.73 GRM2 (0.37)
SCHEMBL10761387 0.72 MAPT (0.42) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL31703846 0.68 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL10358336 0.67 SMN1; SMN2 (0.41) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL617735 0.65 SMN1; SMN2 (0.61) SMN1; SMN2RAB9ANPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1538215-B1 PROCESSES FOR PRODUCING LACTONE TAKASAGO PERFUMERY CO LTD (JP) 2014-11-12 EP disclosed
EP-0609441-B1 Oxazolidone derivatives as monoamine oxidase inhibitors EISAI CO LTD (JP) 1999-07-21 EP disclosed
US-5475014-A Monoamine oxidase inhibor; antidepressant EISAI CO., LTD. (JP) 1995-12-12 US disclosed
EP-0609441-A1 OXAZOLIDONE DERIVATIVE Eisai Co., Ltd. (JP) 1994-08-10 EP disclosed