SCHEMBL10907718

SCHEMBL10907718

O=c1[nH]c(=S)[nH]c2scnc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 1/20 0.46
NSD2 O96028 1/20 0.37
CASP6 P55212 1/20 0.37
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
PKM P14618 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
USP2 O75604 1/20 0.34
GLA P06280 1/20 0.34
THRB P10828 1/20 0.34
TNNI3 P19429 1/20 0.34
TNNT2 P45379 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
TNNC1 P63316 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34

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
SCHEMBL4406750 0.80 CSNK2A1 (0.36) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL1560836 0.67 PARP1 (0.51) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL17819122 0.64 DAO (0.39) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL5441685 0.64 KDM4E (0.42) MEN1KMT2AALDH1A1NSD2CASP6
SCHEMBL5426665 0.63 NSD2 (0.46) MEN1KMT2AALDH1A1NSD2CASP6
SCHEMBL1551529 0.63 CSNK2A1 (0.41) CSNK2A1
SCHEMBL1559735 0.60 PARP1 (0.44) ALDH1A1KDM4EMAPTTDP1THRB
SCHEMBL8278863 0.60 MAPK1 (0.43) ALDH1A1MAPK1KDM4EMAPTL3MBTL1
SCHEMBL10842207 0.60
SCHEMBL4379221 0.59 KMT2A (0.45) MEN1KMT2AALDH1A1MAPK1NSD2

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
WO-2008059368-A2 FUSED 2-AMINO PYRIMIDINE COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CANCER PFIZER PRODUCTS INC. (US) 2008-05-22 WO disclosed
US-4617258-A WATER SOLUBLE GROUP 8 COMPOUNDS KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1986-10-14 US disclosed
US-4477561-A PLATIUM, DALLADIUM, RHODIUM, IRIDIUM AND OSMIUM SALTS; LIGHT SENSITIVE KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1984-10-16 US disclosed
EP-0091788-A2 Silver halide photographic material KONICA CORPORATION (JP) 1983-10-19 EP disclosed
EP-0087880-A2 Silver halide photographic material KONICA CORPORATION (JP) 1983-09-07 EP disclosed