SCHEMBL20626850

SCHEMBL20626850

Oc1ccc(-c2ncccc2SSc2cccnc2-c2ccc(O)cn2)nc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
KDM4E B2RXH2 3/20 0.32
TDP1 Q9NUW8 2/20 0.32
HSD17B1 P14061 2/20 0.32
HSD17B2 P37059 2/20 0.32
BCHE P06276 1/20 0.32
HPGD P15428 2/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL20626849 0.79 PSMD14 (0.36) ALDH1A1MEN1KMT2ACASP1CASP7
SCHEMBL28453842 0.79 METAP2 (0.51) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL4379881 0.75 ALDH1A1 (0.32) ALDH1A1MEN1KMT2ACASP1CASP7
SCHEMBL4926077 0.75 TRPV1 (0.53) MEN1KMT2ATRPV1PAX8
SCHEMBL2645103 0.71 KDM4E (0.61) ALDH1A1KDM4ETDP1HPGDNPC1
SCHEMBL29705476 0.71 KDM4E (0.61) ALDH1A1KDM4ETDP1HPGDNPC1
SCHEMBL30516908 0.71 KDM4E (0.61) ALDH1A1KDM4ETDP1HPGDNPC1
SCHEMBL30958843 0.71 CCR1 (0.46) ALDH1A1MEN1KMT2AKDM4EHSD17B1
SCHEMBL1070654 0.71 CCR1 (0.46) ALDH1A1MEN1KMT2AKDM4EHSD17B1
SCHEMBL17992202 0.70 COMT (0.47) ALDH1A1MEN1KMT2AKDM4ETDP1

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
US-10173997-B2 Bipyridine compound and use of same for noxious arthropod control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-01-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10173997-B2 Bipyridine compound and use of same for noxious arthropod control BBOX1, ACHE, MORF4L1 ALDH1A1 2823/4885MEN1 4871/4885KMT2A 4252/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.