SCHEMBL7572805

SCHEMBL7572805

N#Cc1ccc(C(=S)S)c(Cc2ccccc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.40
BCL2L1 Q07817 1/20 0.40
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
MAOB P27338 3/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
MAOA P21397 2/20 0.37
LMNA P02545 1/20 0.37
ALOX5 P09917 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
PTPN1 P18031 2/20 0.35
PTPN2 P17706 1/20 0.35
PTPN6 P29350 1/20 0.35
TSHR P16473 1/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL28219660 0.83 PTPN1 (0.49) BCL2BCL2L1LMNAPTPN1PTPN2
SCHEMBL7584267 0.78 MEN1 (0.58) BCL2BCL2L1ALDH1A1MAPTLMNA
SCHEMBL7573416 0.78 BCL2 (0.42) BCL2BCL2L1ALDH1A1LMNAALOX5
SCHEMBL6270999 0.77 TSHR (0.49) BCL2BCL2L1ALDH1A1MAPTALOX5
SCHEMBL5208540 0.76 MAOB (0.43) BCL2BCL2L1CYP11B1CYP11B2MAOB
SCHEMBL10595252 0.75 LMNA (0.43) LMNAMEN1KMT2APTPN1PTPN2
SCHEMBL7582708 0.75 MEN1 (0.40) BCL2BCL2L1ALDH1A1MAPTLMNA
SCHEMBL7582814 0.75 ALDH1A1 (0.49) CYP11B1CYP11B2ALDH1A1LMNAMEN1
SCHEMBL27402207 0.74 SLC5A2 (0.47) BCL2BCL2L1CYP11B1CYP11B2MAOB
SCHEMBL6804939 0.74 KDM4E (0.45) BCL2BCL2L1CYP11B1CYP11B2MAOB

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-6458968-B2 REACTING A CARBOXYLIC ACID COMPOUND WITH AN ALCOHOL OR MERCAPTAN, THEN PHOSPHORUS PENTASULFIDE RENSSELAER POLYTECHNIC INSTITUTE 2002-10-01 US claimed
US-20020019554-A1 Dithiocarboxylic ester synthetic process RENSSELAER POLYTECHNIC INSTITUTE 2002-02-14 US claimed
US-6458968-B2 REACTING A CARBOXYLIC ACID COMPOUND WITH AN ALCOHOL OR MERCAPTAN, THEN PHOSPHORUS PENTASULFIDE RENSSELAER POLYTECHNIC INSTITUTE 2002-10-01 US disclosed
US-20020019554-A1 Dithiocarboxylic ester synthetic process RENSSELAER POLYTECHNIC INSTITUTE 2002-02-14 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-20020019554-A1 Dithiocarboxylic ester synthetic process TST, PCCA, CTH BCL2 4622/4885BCL2L1 4596/4885CYP11B1 320/4885

“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.