SCHEMBL9733292

SCHEMBL9733292

CCN1CCN(Cc2nc3sc(S(N)(=O)=O)cc3c(=O)n2-c2ccccc2Cl)CC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HIF1A Q16665 10/20 0.44
ALDH1A1 P00352 4/20 0.42
TSHR P16473 1/20 0.41
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
HSD17B10 Q99714 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL9734163 0.93 HIF1A (0.48) MEN1KMT2AHIF1AALDH1A1TSHR
SCHEMBL9733634 0.90 ALDH1A1 (0.54) MEN1KMT2AHIF1AALDH1A1SMN1; SMN2
SCHEMBL9733484 0.88 MEN1 (0.48) MEN1KMT2AHIF1AALDH1A1TSHR
SCHEMBL9733681 0.87 ALDH1A1 (0.45) ALDH1A1CYP2D6CYP2C19
SCHEMBL9733574 0.86 KMT2A (0.45) MEN1KMT2AHIF1AALDH1A1RXFP1
SCHEMBL9734887 0.86 MEN1 (0.47) MEN1KMT2AHIF1AALDH1A1TSHR
SCHEMBL9734053 0.86 MEN1 (0.47) MEN1KMT2AHIF1AALDH1A1TSHR
SCHEMBL9733850 0.85 ALDH1A1 (0.41) MEN1KMT2AALDH1A1CYP2D6CYP2C19
SCHEMBL9733701 0.84 ALDH1A1 (0.47) MEN1KMT2AALDH1A1CYP2D6CYP2C19
SCHEMBL9734002 0.83 MALT1 (0.47) MEN1KMT2AALDH1A1CYP2D6CYP2C19

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-5124331-A Anticancer agents YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-06-23 US claimed
EP-0364598-A1 3,4-dihydrothieno ¬2,3-d pyrimidine compounds and pharmaceutical application thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1990-04-25 EP claimed
US-5124331-A Anticancer agents YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-06-23 US disclosed
EP-0364598-A1 3,4-dihydrothieno ¬2,3-d pyrimidine compounds and pharmaceutical application thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1990-04-25 EP disclosed