SCHEMBL30251663

SCHEMBL30251663

O=C(O)c1cnc2ncsc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
HKDC1 Q2TB90 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
DAO P14920 2/20 0.43
MGAM O43451 1/20 0.40
P4HA1 P13674 3/20 0.38
P4HTM Q9NXG6 2/20 0.38
MIF P14174 1/20 0.37
HCAR2 Q8TDS4 5/20 0.36
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
PKM P14618 1/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36

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
SCHEMBL23858342 1.00 KDM4E (0.54) KDM4ENPC1RAB9AHKDC1TDP1
SCHEMBL21061877 0.84 NPC1 (0.41) KDM4ENPC1RAB9AHKDC1TDP1
SCHEMBL31003177 0.84 NPC1 (0.41) KDM4ENPC1RAB9AHKDC1TDP1
SCHEMBL23350442 0.80 MAPK1 (0.44) KDM4ENPC1RAB9AHKDC1TDP1
SCHEMBL21958562 0.72 DAO (0.32) KDM4ENPC1RAB9AHKDC1TDP1
SCHEMBL31292233 0.71 DAO (0.38) KDM4ENPC1RAB9AHKDC1TDP1
SCHEMBL4715955 0.70 KDM4E (0.50) KDM4ENPC1RAB9AHKDC1TDP1
SCHEMBL192332 0.70 NPC1 (1.00) KDM4ENPC1RAB9AHKDC1TDP1
SCHEMBL21061964 0.70 KDM4E (0.58) KDM4ENPC1RAB9AHKDC1TDP1
SCHEMBL20031275 0.70 NPC1 (0.53) KDM4ENPC1RAB9AMGAMHCAR2

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
CN-115335378-B Monoacylglycerol lipase modulators 詹森药业有限公司 2025-03-04 CN disclosed
EP-4126860-A1 MONOACYLGLYCEROL LIPASE MODULATORS Janssen Pharmaceutica NV (BE) 2023-02-08 EP disclosed