SCHEMBL11201322

SCHEMBL11201322

CNc1nc(N2CCN(C=O)CC2)nc2sc3c(c12)CCCC3

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 8/20 0.41
KDM4E B2RXH2 6/20 0.41
ALOX15 P16050 5/20 0.41
LMNA P02545 5/20 0.41
USP2 O75604 2/20 0.41
SMN1; SMN2 Q16637 6/20 0.40
MAPT P10636 6/20 0.40
HPGD P15428 6/20 0.40
HTT P42858 5/20 0.40
HSD17B10 Q99714 5/20 0.40
GAA P10253 4/20 0.40
TSHR P16473 3/20 0.40
POLB P06746 2/20 0.40
MAPK1 P28482 2/20 0.40
GLA P06280 2/20 0.40
RAD52 P43351 1/20 0.40
PAX8 Q06710 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL11208644 0.99 MEN1 (0.42) MEN1KMT2AALDH1A1KDM4EALOX15
SCHEMBL11204627 0.98 MAPT (0.42) MEN1KMT2AALDH1A1KDM4EALOX15
SCHEMBL11204226 0.89 ALDH1A1 (0.50) MEN1KMT2AALDH1A1KDM4EALOX15
SCHEMBL11202830 0.85 MEN1 (0.58) MEN1KMT2AALDH1A1KDM4EALOX15
SCHEMBL11197580 0.85 ALDH1A1 (0.57) MEN1KMT2AALDH1A1KDM4EALOX15
Hydrochloric Acid SCHEMBL11200717 0.84 MEN1 (0.57) MEN1KMT2AALDH1A1KDM4EALOX15
SCHEMBL11203500 0.84 ALDH1A1 (0.56) MEN1KMT2AALDH1A1KDM4EALOX15
SCHEMBL11202220 0.83 RAB9A (0.48) MEN1KMT2AALDH1A1KDM4EALOX15
SCHEMBL11202996 0.83 KDM4E (0.43) MEN1KMT2AALDH1A1KDM4EALOX15
SCHEMBL11197698 0.83 ALDH1A1 (0.55) MEN1KMT2AALDH1A1KDM4EALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0082023-A2 Thienopyrimidine derivatives, their preparation and their medical use SANKYO COMPANY LIMITED (JP) 1983-06-22 EP disclosed