SCHEMBL7280348

SCHEMBL7280348

Cc1nc(=O)c(C#N)c(NCc2ccco2)[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 7/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
PKM P14618 1/20 0.48
KDM4E B2RXH2 12/20 0.45
ALDH1A1 P00352 10/20 0.45
GAA P10253 8/20 0.45
HPGD P15428 6/20 0.45
TSHR P16473 2/20 0.45
CASP1 P29466 2/20 0.45
GLA P06280 1/20 0.45
CASP7 P55210 1/20 0.45
ALOX15 P16050 1/20 0.45
MAPK10 P53779 1/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 5/20 0.44
POLB P06746 2/20 0.44
NPSR1 Q6W5P4 2/20 0.43

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
SCHEMBL7291924 0.80 PDE4A (0.52) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL7289446 0.78 PDE4A (0.53) KDM4EALDH1A1GAAHPGDTSHR
Hydrochloric Acid SCHEMBL7288081 0.77 PDE4A (0.52) KDM4EALDH1A1GAAHPGDTSHR
SCHEMBL7282267 0.76 GAA (0.41) HSD17B10KDM4EALDH1A1GAAHPGD
SCHEMBL7291598 0.76 KDM4E (0.47) HSD17B10MEN1KMT2AKDM4EALDH1A1
Pelrinone SCHEMBL783978 0.75 PDE4A (0.71) HSD17B10MEN1KMT2AKDM4EALDH1A1
Pelrinone SCHEMBL124976 0.74 PDE4A (0.70) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL7289945 0.72 LMNA (0.54) MEN1KMT2APKMKDM4EALDH1A1
SCHEMBL7288660 0.71 PDE4A (0.38) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL7282870 0.71 PDE4B (0.46) MEN1KMT2AKDM4EALDH1A1GAA

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
US-4505910-A Amino-pyrimidine derivatives, compositions and use AMERICAN HOME PRODUCTS CORPORATION (US) 1985-03-19 US claimed
EP-0130735-A1 Amino-pyrimidine derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1985-01-09 EP claimed
US-4505910-A Amino-pyrimidine derivatives, compositions and use AMERICAN HOME PRODUCTS CORPORATION (US) 1985-03-19 US disclosed
EP-0130735-A1 Amino-pyrimidine derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1985-01-09 EP disclosed