SCHEMBL7010909

SCHEMBL7010909

CCc1c(C)[nH]c(=O)c(N)c1Sc1cc(C)cc(C)c1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TYMS P04818 13/20 0.34
DHFR P00374 4/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL7009670 0.79 GRIN2D (0.41) PDE3BPDE3ASMN1; SMN2HSD17B10TYMS
SCHEMBL7007080 0.77 MAPT (0.39) PDE3BPDE3ASMN1; SMN2HSD17B10HTT
SCHEMBL7010610 0.77 ALDH1A1 (0.46) PDE3BPDE3AMAPT
SCHEMBL7013173 0.75 TYMS (0.32) TYMSDHFRPKMHTTMAPT
SCHEMBL5701705 0.74 KDM4E (0.39) PDE3BPDE3ASMN1; SMN2HSD17B10DHFR
SCHEMBL7012912 0.72 SMN1; SMN2 (0.38) PDE3BPDE3ASMN1; SMN2HSD17B10HTT
SCHEMBL8086596 0.70 KDM4E (0.44) SMN1; SMN2HSD17B10MAPT
SCHEMBL7007761 0.70 MCL1 (0.33) TYMSDHFR
SCHEMBL9846258 0.69 TYMP (0.39) PDE3BPDE3ASMN1; SMN2HSD17B10HTT
SCHEMBL6086721 0.69 TYMP (0.37) PDE3BPDE3ASMN1; SMN2HSD17B10DHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0843663-B9 4-ARYL-THIO-PYRIDIN-2(1H)-ONES, DRUGS CONTAINING SAME, AND USES THEREOF FOR TREATING HIV-RELATED DISEASES CENTRE NAT RECH SCIENT (FR) 2003-10-29 EP claimed
EP-0843663-B1 4-ARYL-THIO-PYRIDIN-2(1H)-ONES, DRUGS CONTAINING SAME, AND USES THEREOF FOR TREATING HIV-RELATED DISEASES CENTRE NAT RECH SCIENT (FR) 2003-04-09 EP claimed
US-6015820-A VIRICIDES; AIDS TREATMENT CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2000-01-18 US claimed
EP-0843663-B9 4-ARYL-THIO-PYRIDIN-2(1H)-ONES, DRUGS CONTAINING SAME, AND USES THEREOF FOR TREATING HIV-RELATED DISEASES CENTRE NAT RECH SCIENT (FR) 2003-10-29 EP disclosed
EP-0843663-B1 4-ARYL-THIO-PYRIDIN-2(1H)-ONES, DRUGS CONTAINING SAME, AND USES THEREOF FOR TREATING HIV-RELATED DISEASES CENTRE NAT RECH SCIENT (FR) 2003-04-09 EP disclosed
US-6015820-A VIRICIDES; AIDS TREATMENT CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2000-01-18 US disclosed
WO-1997005113-A1 4-ARYL-THIO-PYRIDIN-2(1H)-ONES, DRUGS CONTAINING SAME, AND USES THEREOF FOR TREATING HIV-RELATED DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1997-02-13 WO disclosed