SCHEMBL9870534

SCHEMBL9870534

Cc1ccnc(CSc2nc(C)cc(=O)[nH]2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSD A5PKW4 1/20 0.62
ALDH1A1 P00352 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.56
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
LMNA P02545 2/20 0.54
MMP13 P45452 1/20 0.54
KDM4E B2RXH2 2/20 0.54
PKM P14618 1/20 0.54
HPGD P15428 3/20 0.53
TSHR P16473 2/20 0.53
USP2 O75604 1/20 0.53
POLB P06746 1/20 0.53
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
NPSR1 Q6W5P4 1/20 0.50
MAPT P10636 2/20 0.49
TP53 P04637 1/20 0.49

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
SCHEMBL9872522 0.84 ALDH1A1 (0.62) PSDALDH1A1SMN1; SMN2L3MBTL1LMNA
SCHEMBL9876064 0.77 GLA (0.72) ALDH1A1SMN1; SMN2LMNAHPGDTSHR
SCHEMBL19099442 0.77 PSD (1.00) PSDALDH1A1SMN1; SMN2L3MBTL1NPC1
SCHEMBL9870231 0.75 LMNA (0.57) PSDALDH1A1SMN1; SMN2L3MBTL1NPC1
SCHEMBL18063501 0.74 HPGD (0.73) ALDH1A1SMN1; SMN2L3MBTL1RAB9ALMNA
SCHEMBL14485993 0.74 DAO (0.56) LMNA
SCHEMBL11464707 0.73 CYP2E1 (0.65) ALDH1A1SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL1890037 0.73 GPR84 (0.67) ALDH1A1L3MBTL1NPC1RAB9ALMNA
SCHEMBL9879743 0.73 MAPT (0.55) PSDALDH1A1SMN1; SMN2L3MBTL1NPC1
SCHEMBL16910517 0.71 L3MBTL1 (0.61) ALDH1A1SMN1; SMN2L3MBTL1NPC1RAB9A

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
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