Thiamiprine

Thiamiprine

SCHEMBL28239157

Cn1cnc([N+](=O)[O-])c1Sc1nc(=N)[nH]c2[nH]cnc12.Nc1nc(=S)c2[nH]cnc2[nH]1.S=P(N1CC1)(N1CC1)N1CC1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

IMPDH1IMPDH2

The experimentally established mechanism targets of Thiamiprine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.41
HBB P68871 3/20 0.41
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
GMNN O75496 1/20 0.41
PGR P06401 1/20 0.41
CYP3A4 P08684 1/20 0.41
SLC6A4 P31645 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 6/20 0.37
HPGD P15428 2/20 0.37
USP2 O75604 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
PTGS1 P23219 1/20 0.37
MAPK3 P27361 1/20 0.37
XDH P47989 1/20 0.37
PAX8 Q06710 1/20 0.37

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
Thiamiprine SCHEMBL27866409 0.93 MAPT (0.47) MAPTHBBTP53SMN1; SMN2LMNA
Thiamiprine SCHEMBL28142582 0.85 HBB (0.36) MAPTHBBTP53SMN1; SMN2LMNA
Thiamiprine SCHEMBL28095327 0.80 MAPT (0.53) MAPTHBBTP53SMN1; SMN2LMNA
Thioguanine SCHEMBL27787425 0.71 ALDH1A1 (0.72) HBBTP53SMN1; SMN2LMNACYP3A4
Azathioprine SCHEMBL5716607 0.67 MAPT (0.67) MAPTHBBTP53SMN1; SMN2LMNA
Thiamiprine SCHEMBL29350246 0.67 CYP1A2 (0.56) MAPTHBBTP53SMN1; SMN2LMNA
Thiamiprine SCHEMBL4852 0.67 CYP1A2 (0.56) MAPTHBBTP53SMN1; SMN2LMNA
Thiamiprine SCHEMBL15284276 0.66 MAPT (0.59) MAPTHBBTP53SMN1; SMN2LMNA
Azathioprine SCHEMBL8018151 0.65 MAPT (0.75) MAPTHBBTP53SMN1; SMN2LMNA
Azathioprine SCHEMBL8354969 0.65 MAPT (0.82) MAPTHBBTP53SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110325533-A INHIBITORS OF THE MENIN-MLL INTERACTION 生命医药有限责任公司 2019-10-11 CN disclosed
CN-109414436-A Treatment of hematological malignancies with 2- (4-chlorophenyl) -N- ((2- (2, 6-dioxopiperidin-3-yl) -1-oxoisoindolin-5-yl) methyl) -2, 2-difluoroacetamide 细胞基因公司 2019-03-01 CN disclosed
CN-108712904-A The solid form of two Fluorakil 100s of 2- (4- chlorphenyls)-N- ((2- (2,6- dioxopiperidine -3- bases) -1- oxoisoindolines -5- bases) methyl) -2,2- and its pharmaceutical composition and purposes 细胞基因公司 2018-10-26 CN disclosed
CN-108430473-A Antiproliferative compounds and pharmaceutical compositions and uses thereof 细胞基因公司 2018-08-21 CN disclosed