SCHEMBL22056725

SCHEMBL22056725

COC(=O)c1ccnc(SC)c1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.49
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ ATR Q13535 1/20 0.45
▸ PSMD14 O00487 1/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ TSHR P16473 2/20 0.43
▸ PKM P14618 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ CASP3 P42574 2/20 0.42
▸ SENP8 Q96LD8 2/20 0.42
▸ SENP7 Q9BQF6 2/20 0.42
▸ SENP6 Q9GZR1 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ GAA P10253 1/20 0.41

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
SCHEMBL22056902 0.81 PKM (0.42) MEN1KMT2APSMD14L3MBTL1TSHR
SCHEMBL1970174 0.80 ATR (0.56) ATRPSMD14L3MBTL1TSHRALDH1A1
SCHEMBL23500690 0.78 ATR (0.48) ATRPSMD14L3MBTL1ALDH1A1RAB9A
SCHEMBL3717527 0.77 KMT2A (0.72) MEN1KMT2AL3MBTL1TSHRPKM
SCHEMBL3630664 0.77 GAA (0.51) ATRPSMD14TSHRALDH1A1KDM4E
SCHEMBL23500830 0.77 ATR (0.50) ATRPSMD14L3MBTL1TSHRALDH1A1
SCHEMBL4075916 0.77 ATR (0.47) ATRPSMD14ALDH1A1KDM4EGLA
SCHEMBL31133297 0.75 ATR (0.46) ATRPSMD14L3MBTL1TSHRPKM
SCHEMBL14667063 0.74 RXFP1 (0.52) RXFP1MEN1KMT2AATRL3MBTL1
SCHEMBL31132555 0.74 ATR (0.48) ATRPSMD14L3MBTL1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220013730-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK KGAA (DE) 2022-01-13 — — US disclosed
WO-2020109434-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-06-04 — — WO 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-20220013730-A1 COMPOUNDS FOR ELECTRONIC DEVICES ETV6, CYP2C19, ESR1 RXFP1 4633/4885MEN1 153/4885KMT2A 1896/4885

“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.

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