SCHEMBL2449734

SCHEMBL2449734

CCCCCc1ccccc1C(=S)OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.49
ALOX5 P09917 1/20 0.47
PTGS2 P35354 1/20 0.47
PPARA Q07869 2/20 0.42
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.40
CYP3A4 P08684 2/20 0.40
ALOX12 P18054 1/20 0.40
KMT2A Q03164 1/20 0.40
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40
BID P55957 3/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
BAK1 Q16611 2/20 0.39
KAT8 Q9H7Z6 2/20 0.39
PPARG P37231 1/20 0.39

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
SCHEMBL7336817 0.85 LMNA (0.41) ALDH1A1LMNAKMT2A
SCHEMBL5815657 0.81 LIPG (0.53) LIPGALOX5PTGS2PPARATHRA
SCHEMBL2453233 0.81 LIPG (0.53) LIPGALOX5PTGS2PPARATHRA
SCHEMBL10951024 0.80 ALDH1A1 (0.43) ALDH1A1LMNATSHRKMT2A
SCHEMBL28106654 0.80 ALDH1A1 (0.64) LIPGALOX5PTGS2PPARATHRA
SCHEMBL2081561 0.79 LIPG (0.51) LIPGALOX5PTGS2PPARATHRA
SCHEMBL11570756 0.79 LIPG (0.56) LIPGPPARATHRATHRBBID
SCHEMBL10384517 0.79 LIPG (0.51) LIPGALOX5PTGS2PPARATHRA
SCHEMBL11569407 0.79 LIPG (0.56) LIPGPPARATHRATHRBBID
SCHEMBL9456052 0.79 LIPG (0.56) LIPGPPARATHRATHRBBID

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8022072-B2 Azolylmethylidenehydrazine derivative and use thereof KAKEN PHARMACEUTICAL CO., LTD. (JP) 2011-09-20 US disclosed
US-20100190754-A1 AZOLYLMETHYLIDENEHYDRAZINE DERIVATIVE AND USE THEREOF KAKEN PHARMACEUTICAL CO., LTD. (JP) 2010-07-29 US disclosed
EP-2168951-A1 AZOLYLMETHYLENEHYDRAZINE DERIVATIVE AND USE THEREOF KAKEN PHARMACEUTICAL CO., LTD. (JP) 2010-03-31 EP 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-20100190754-A1 AZOLYLMETHYLIDENEHYDRAZINE DERIVATIVE AND USE THEREOF ARSA, AHR, HRH2 LIPG 4573/4885ALOX5 289/4885PTGS2 105/4885

“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.