SCHEMBL9870231

SCHEMBL9870231

CCc1ccc(CSc2nc(C)cc(=O)[nH]2)nc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
MMP13 P45452 1/20 0.57
ALDH1A1 P00352 3/20 0.57
GPR84 Q9NQS5 2/20 0.54
ESR2 Q92731 1/20 0.54
HPGD P15428 2/20 0.53
TSHR P16473 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
USP2 O75604 1/20 0.53
MAPT P10636 2/20 0.52
KDM4E B2RXH2 1/20 0.51
PKM P14618 1/20 0.51
PSD A5PKW4 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
POLB P06746 1/20 0.50
NPC1 O15118 1/20 0.49
TP53 P04637 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48

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 0.78 ALDH1A1 (0.62) LMNAMMP13ALDH1A1HPGDTSHR
SCHEMBL9879743 0.77 MAPT (0.55) LMNAMMP13ALDH1A1GPR84HPGD
SCHEMBL9870534 0.75 PSD (0.62) LMNAMMP13ALDH1A1GPR84HPGD
SCHEMBL18063501 0.74 HPGD (0.73) LMNAMMP13ALDH1A1HPGDTSHR
SCHEMBL1890037 0.73 GPR84 (0.67) LMNAMMP13ALDH1A1GPR84HPGD
SCHEMBL30776798 0.73 LMNA (1.00) LMNAMMP13ALDH1A1GPR84HPGD
SCHEMBL17383001 0.72 ALDH1A1 (1.00) LMNAALDH1A1ESR2TSHRL3MBTL1
SCHEMBL27347948 0.71 ALDH1A1 (0.38) LMNAMMP13ALDH1A1GPR84ESR2
SCHEMBL16910497 0.69 HPGD (0.73) LMNAMMP13ALDH1A1HPGDTSHR
SCHEMBL17382802 0.69 HDAC6 (0.71) LMNAMMP13ALDH1A1GPR84ESR2

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