SCHEMBL9364000

SCHEMBL9364000

NC(=O)c1ncn(COCCO)c1NC(N)=S

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
PNP P00491 2/20 0.41
USP2 O75604 1/20 0.41
EDNRA P25101 1/20 0.41
HTR2A P28223 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
HBB P68871 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ATIC P31939 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HPRT1 P00492 1/20 0.31
ADK P55263 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL9364010 0.79 ALDH1A1 (0.36) MEN1KMT2AALDH1A1LMNA
SCHEMBL9367320 0.77 ALDH1A1 (0.35) MEN1KMT2AALDH1A1LMNA
SCHEMBL9363575 0.74 PKM (0.51) TSHRPNPALDH1A1
SCHEMBL9364454 0.71 ALDH1A1 (0.39) MEN1KMT2AALDH1A1LMNA
SCHEMBL9363532 0.64 TSHR (0.45) TSHRPNPUSP2EDNRAHTR2A
SCHEMBL9368918 0.64 ALDH1A1 (0.47) KMT2AALDH1A1LMNA
SCHEMBL9845265 0.63 TSHR (0.40) TSHRPNPUSP2EDNRAHTR2A
SCHEMBL17963617 0.61 PNP (0.43) TSHRPNPUSP2EDNRAHTR2A
SCHEMBL19181966 0.59 PNP (0.48) TSHRPNPUSP2EDNRAHTR2A
SCHEMBL1049988 0.59 PNP (0.57) TSHRPNPUSP2EDNRAHTR2A

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
EP-0464112-B1 A PROCESS FOR THE PREPARATION OF 9-SUBSTITUTED GUANINE DERIVATIVES AND INTERMEDIATES FOR USE IN THE PROCESS GEA FARMACEUTISK FABRIK AS (DK) 1994-10-05 EP disclosed
US-5223619-A Catalytic cyclization A/S GEA FARMACEUTISK FABRIK (DK) 1993-06-29 US disclosed
EP-0464112-A1 A PROCESS FOR THE PREPARATION OF 9-SUBSTITUTED GUANINE DERIVATIVES AND INTERMEDIATES FOR USE IN THE PROCESS. GEA FARMACEUTISK FABRIK AS (DK) 1992-01-08 EP disclosed
WO-1990011283-A1 A PROCESS FOR THE PREPARATION OF 9-SUBSTITUTED GUANINE DERIVATIVES AND INTERMEDIATES FOR USE IN THE PROCESS A/S GEA FARMACEUTISK FABRIK (DK) 1990-10-04 WO disclosed