SCHEMBL11200264

SCHEMBL11200264

CCc1cc2c(N)nc(N3CCSCC3)nc2s1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.48
ADORA2A P29274 9/20 0.46
ADORA1 P30542 8/20 0.46
KDM4E B2RXH2 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TMIGD3 P0DMS9 1/20 0.44
RAB9A P51151 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HRH4 Q9H3N8 1/20 0.43
HTT P42858 1/20 0.42
P2RY12 Q9H244 3/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 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
SCHEMBL11199830 0.89 HTR6 (0.61) HTR6KDM4ESMN1; SMN2TMIGD3RAB9A
SCHEMBL11197610 0.87 P2RY12 (0.52) HTR6ADORA2AADORA1KDM4ESMN1; SMN2
SCHEMBL11203412 0.87 HTR6 (0.49) HTR6ADORA2AADORA1KDM4ESMN1; SMN2
SCHEMBL11199696 0.85 HTR6 (0.50) HTR6ADORA2AADORA1KDM4ESMN1; SMN2
SCHEMBL11202466 0.84 HTR6 (0.46) HTR6ADORA2AKDM4ESMN1; SMN2TMIGD3
SCHEMBL11200700 0.83 P2RY12 (0.51) HTR6KDM4ESMN1; SMN2TMIGD3RAB9A
SCHEMBL11205948 0.83 P2RY12 (0.48) HTR6ADORA2AADORA1KDM4ESMN1; SMN2
SCHEMBL11203122 0.82 P2RY12 (0.52) HTR6MEN1P2RY12
SCHEMBL11202874 0.82 HTR6 (0.43) HTR6KDM4ESMN1; SMN2TMIGD3RAB9A
SCHEMBL11204622 0.81 ADRA1A (0.54) HTR6RAB9AMEN1P2RY12

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