SCHEMBL7196501

SCHEMBL7196501

CCOC(=O)N1CCc2c(sc3nc(-c4cccnc4)nc(Cl)c23)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 1/20 0.51
KDM4E B2RXH2 5/20 0.49
RXFP1 Q9HBX9 2/20 0.49
ALDH1A1 P00352 5/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 2/20 0.47
POLB P06746 1/20 0.47
HPGD P15428 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PRKCI P41743 6/20 0.47
PKM P14618 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
TP53 P04637 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NFKB1 P19838 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL7199532 0.83 KDM4E (0.58) WEE1KDM4ERXFP1ALDH1A1MAPT
SCHEMBL7195650 0.81 PRKCI (0.47) WEE1KDM4EALDH1A1MAPTLMNA
SCHEMBL969839 0.80 KDM4E (0.58) WEE1KDM4ERXFP1ALDH1A1MAPT
SCHEMBL7199531 0.78 RXFP1 (0.52) WEE1KDM4ERXFP1ALDH1A1MAPT
SCHEMBL7172235 0.77 KDM4E (0.56) KDM4EALDH1A1MAPTLMNAHTT
SCHEMBL967213 0.75 RXFP1 (0.66) WEE1KDM4ERXFP1ALDH1A1MAPT
SCHEMBL7013488 0.75 ALDH1A1 (0.55) KDM4ERXFP1ALDH1A1MAPTLMNA
SCHEMBL7609437 0.74 KDM4E (0.74) KDM4EALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7198624 0.72 PRKCI (0.54) KDM4EALDH1A1MAPTPRKCI
SCHEMBL968341 0.71 KDM4E (0.59) WEE1KDM4ERXFP1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1323719-A1 Thienopyrimidine compounds and salts thereof and process for the preparation of the same NIPPON SODA CO., LTD. (JP) 2003-07-02 EP disclosed
US-6482948-B1 Thienopyrimidine compounds and salts thereof and process for the preparation of the same NIPPON SODA CO., LTD. (JP) 2002-11-19 US disclosed
EP-1167367-A1 THIENOPYRIMIDINE COMPOUNDS AND SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME NIPPON SODA CO., LTD. (JP) 2002-01-02 EP disclosed