SCHEMBL7324699

SCHEMBL7324699

Clc1nc(N2CCSCC2)c2ccccc2n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
HPGD P15428 3/20 0.49
HSD17B10 Q99714 2/20 0.49
GLA P06280 2/20 0.49
GAA P10253 2/20 0.49
TSHR P16473 1/20 0.49
ACP1 P24666 2/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 6/20 0.46
ATM Q13315 2/20 0.46
MAPK1 P28482 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
MAPT P10636 4/20 0.46
ALDH1A1 P00352 4/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46

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
SCHEMBL29161535 0.85 L3MBTL1 (0.61) ABCB1L3MBTL1HPGDHSD17B10GLA
SCHEMBL8381868 0.85 L3MBTL1 (0.66) ABCB1L3MBTL1HPGDHSD17B10GLA
SCHEMBL30774303 0.85 L3MBTL1 (0.66) ABCB1L3MBTL1HPGDHSD17B10GLA
SCHEMBL3641468 0.84 L3MBTL1 (0.69) ABCB1L3MBTL1HPGDHSD17B10GLA
SCHEMBL1089156 0.84 L3MBTL1 (0.69) ABCB1L3MBTL1HPGDHSD17B10GLA
SCHEMBL27484768 0.81 CYP1A2 (0.67) HPGDHSD17B10TSHRMEN1KMT2A
SCHEMBL5320912 0.81 HTR3B (0.69) HPGDHSD17B10TSHRMEN1KMT2A
SCHEMBL4095134 0.81 KDM4E (0.69) HPGDHSD17B10GLAGAATSHR
SCHEMBL24951311 0.81 HPGD (0.48) ABCB1L3MBTL1HPGDHSD17B10GLA
SCHEMBL4091176 0.80 ABCB1 (0.78) ABCB1L3MBTL1HSD17B10TSHRACP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0535104-B1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1996-09-04 EP disclosed
US-5371080-A Central nervous system disorders NOVO NORDISK A/S 1994-12-06 US disclosed
US-5276028-A Psychological disorders, anticonvulsants, anxiolytic or hypnotics and cognition activators NORDISK A/S (DK) 1994-01-04 US disclosed
EP-0535104-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE. NOVO NORDISK AS (DK) 1993-04-07 EP disclosed
WO-1992000298-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-01-09 WO disclosed