SCHEMBL7018509

SCHEMBL7018509

CSc1sccc1-c1ccco1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.40
KMT2A Q03164 6/20 0.40
KDM4E B2RXH2 6/20 0.40
MEN1 O00255 5/20 0.40
BLM P54132 3/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
HSD17B10 Q99714 8/20 0.39
HPGD P15428 5/20 0.39
POLB P06746 4/20 0.39
ALOX15 P16050 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
PTPN7 P35236 2/20 0.39
RECQL P46063 2/20 0.39
SAE1 Q9UBE0 2/20 0.39
UBA2 Q9UBT2 2/20 0.39
GAPDH P04406 1/20 0.39
NR4A1 P22736 1/20 0.39

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
SCHEMBL7016873 0.81 MAPT (0.36) ALDH1A1KMT2AKDM4EMEN1BLM
SCHEMBL18631516 0.76 ALDH1A1 (0.42) ALDH1A1KMT2AKDM4EMEN1BLM
SCHEMBL1800270 0.73 HSD17B10 (0.41) ALDH1A1KMT2AKDM4EMEN1BLM
SCHEMBL9797161 0.70 HSD17B10 (0.38) ALDH1A1KMT2AKDM4EMEN1BLM
SCHEMBL27636828 0.69 PLAU (0.44) ALDH1A1KMT2AKDM4EMEN1RAB9A
SCHEMBL12270203 0.69 TOP1 (0.41) ALDH1A1KMT2AKDM4EMEN1BLM
SCHEMBL7014993 0.68 CFTR (0.38) ALDH1A1KMT2AKDM4EMEN1BLM
SCHEMBL7007247 0.68 POLB (0.39) ALDH1A1KMT2AKDM4EMEN1BLM
SCHEMBL3087314 0.67 ALDH1A1 (0.51) ALDH1A1KMT2AKDM4EMEN1BLM
SCHEMBL10885578 0.66 ADORA1 (0.35) ALDH1A1KMT2AKDM4EMEN1BLM

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
EP-1349861-A1 THIENO(3,2-d)PYRIMIDINES AND FURANO(3,2-d)PYRIMIDINES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS VERNALIS RESEARCH LIMITED (GB) 2003-10-08 EP disclosed
WO-2002055524-A1 THIENO(3,2-d)PYRIMIDINES AND FURANO(3,2-d)PYRIMIDINES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS VERNALIS RESEARCH LIMITED (GB) 2002-07-18 WO disclosed