SCHEMBL9870409

SCHEMBL9870409

CN(C)c1ccccc1CSc1nccc(=O)[nH]1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.47
GLA P06280 1/20 0.46
MAPT P10636 4/20 0.44
NPSR1 Q6W5P4 2/20 0.44
POLB P06746 5/20 0.43
LMNA P02545 4/20 0.43
TDP1 Q9NUW8 2/20 0.42
TSHR P16473 3/20 0.42
HSD17B10 Q99714 2/20 0.42
CASP1 P29466 1/20 0.42
L3MBTL1 Q9Y468 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 2/20 0.42
MAPK1 P28482 1/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
APEX1 P27695 1/20 0.41
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL9838119 0.79 POLB (0.67) MAPTNPSR1POLBLMNATSHR
SCHEMBL9013455 0.79 LMNA (0.41) MAPTNPSR1POLBLMNATSHR
SCHEMBL9872406 0.76 KMT2A (0.72) LMNATSHRALDH1A1HPGDMAPK1
SCHEMBL11338091 0.75 MAPT (0.57) GPR84GLAMAPTNPSR1POLB
SCHEMBL8656211 0.73 HPGD (0.39) MAPTNPSR1POLBLMNATSHR
SCHEMBL9695295 0.73 TP53 (0.67) NPSR1POLBLMNAHSD17B10ALDH1A1
SCHEMBL8658166 0.71 AR (0.39) MAPTNPSR1POLBLMNATDP1
SCHEMBL6483534 0.71 RAB9A (0.64) MAPTNPSR1LMNATSHRHSD17B10
SCHEMBL9870574 0.71 GLA (0.61) GLAMAPTNPSR1LMNATSHR
SCHEMBL26034712 0.71 GPR84 (0.66) GPR84GLAMAPTNPSR1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0391254-A2 Novel thiouracil derivatives pharmaceutical compositions containing them and process for preparing same RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1990-10-10 EP claimed
US-5037830-A Antisecretory-antiulcer agents RICHTER GEDEON VEGYESZETI GYAR RT (HU) 1991-08-06 US disclosed
EP-0391254-A2 Novel thiouracil derivatives pharmaceutical compositions containing them and process for preparing same RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1990-10-10 EP disclosed