SCHEMBL3606616

SCHEMBL3606616

CC(=S)Nc1cccc(Cl)c1Cl

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
LMNA P02545 5/20 0.56
KDM4E B2RXH2 2/20 0.56
POLB P06746 1/20 0.56
MEN1 O00255 9/20 0.56
KMT2A Q03164 9/20 0.56
MAPK1 P28482 1/20 0.53
MAPT P10636 3/20 0.53
HPGD P15428 1/20 0.53
NPSR1 Q6W5P4 3/20 0.53
HTT P42858 1/20 0.51
CACNA1B Q00975 1/20 0.50
APBA1 Q02410 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
GAA P10253 1/20 0.50

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
SCHEMBL13246393 0.83 ALDH1A1 (0.60) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL11541462 0.81 ALDH1A1 (0.58) ALDH1A1LMNAKDM4EPOLBMEN1
SCHEMBL30660901 0.80 MEN1 (0.56) ALDH1A1LMNAKDM4EPOLBMEN1
SCHEMBL30623497 0.80 MEN1 (0.67) ALDH1A1LMNAKDM4EPOLBMEN1
SCHEMBL11441580 0.80 MEN1 (0.56) ALDH1A1LMNAKDM4EPOLBMEN1
SCHEMBL6969191 0.80 MEN1 (0.61) ALDH1A1LMNAKDM4EPOLBMEN1
SCHEMBL650892 0.80 MEN1 (0.56) ALDH1A1LMNAKDM4EPOLBMEN1
SCHEMBL3612815 0.80 MEN1 (0.67) ALDH1A1LMNAKDM4EPOLBMEN1
SCHEMBL21681378 0.80 MEN1 (0.56) ALDH1A1LMNAKDM4EPOLBMEN1
Hydrochloric Acid SCHEMBL21681389 0.78 MEN1 (0.55) ALDH1A1LMNAKDM4EPOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7807684-B2 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-05 US disclosed
US-7807684-B2 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-05 US disclosed
US-7807684-B2 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-05 US disclosed
EP-1912935-A2 HIV REVERSE TRANSCRIPTASE INHIBITORS Merck & Co., Inc. (US) 2008-04-23 EP disclosed
WO-2007015809-A2 HIV REVERSE TRANSCRIPTASE INHIBITORS MERCK & CO., INC. (US) 2007-02-08 WO disclosed
WO-2007015809-A2 HIV REVERSE TRANSCRIPTASE INHIBITORS MERCK & CO., INC. (US) 2007-02-08 WO disclosed
US-20070021442-A1 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. 2007-01-25 US disclosed
US-20070021442-A1 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. 2007-01-25 US disclosed
US-20070021442-A1 HIV reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. 2007-01-25 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-20070021442-A1 HIV reverse transcriptase inhibitors POLRMT, RNGTT, POLR2E ALDH1A1 2363/4885LMNA 2183/4885KDM4E 760/4885

“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.