SCHEMBL2806477

SCHEMBL2806477

Cc1ccccc1C(=O)S(=O)(=O)O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.46
MYC P01106 1/20 0.46
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
KDR P35968 1/20 0.44
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
ELANE P08246 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
SCHEMBL777730 0.84 HPGD (0.47) HPGDMYCERCC5FEN1FLT1
SCHEMBL4390528 0.84 ALDH1A1 (0.46) HPGDTSHRSMN1; SMN2KDM4EALDH1A1
SCHEMBL6262061 0.83 ESR1 (0.45) HPGDMYCHTTTSHRKDM4E
SCHEMBL776932 0.83 HPGD (0.46) HPGDMYCERCC5FEN1FLT1
SCHEMBL20543307 0.81 MYC (0.48) HPGDMYCERCC5FEN1FLT1
SCHEMBL7451599 0.81 FLT1 (0.46) HPGDMYCERCC5FEN1FLT1
SCHEMBL776165 0.79 TSHR (0.48) HPGDMYCERCC5FEN1FLT1
SCHEMBL777052 0.78 HPGD (0.46) HPGDMYCERCC5FEN1FLT1
Toluic Acid SCHEMBL23044119 0.77 ALDH1A1 (0.53) HPGDMYCERCC5FEN1HTT
SCHEMBL3629126 0.76 HPGD (0.41) HPGDMYCERCC5FEN1FLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0364923-B1 MESOMORPHIC COMPOUND, LIQUID CRYSTAL COMPOSITION CONTAINING SAME AND LIQUID CRYSTAL DEVICE USING SAME CANON KABUSHIKI KAISHA (JP) 1993-07-28 EP claimed
EP-0114043-B1 DYE MIXTURES AND THEIR USE IN THE DYEING OF PAPER BAYER AG (DE) 1986-09-10 EP claimed
EP-0114043-A2 Dye mixtures and their use in the dyeing of paper BAYER AG (DE) 1984-07-25 EP claimed
EP-2743262-B1 Method for Obtaining a Triazine Compound with at least one Tertiary Amino Group BOREALIS AGROLINZ MELAMINE (AT) 2016-04-27 EP disclosed
EP-2743262-A1 Method for Obtaining a Triazine Compound with at least one Tertiary Amino Group Borealis Agrolinz Melamine GmbH (AT) 2014-06-18 EP disclosed
US-20100240764-A1 Use of S-Clenbuterol EUCRO EUROPEAN CONTRACT RESEARCH GMBH & CO. KG (DE) 2010-09-23 US disclosed
EP-1754474-A1 Use of S-Clenbuterol Eucro European Contract Research GmbH & Co. KG (DE) 2007-02-21 EP disclosed
WO-2006082046-A1 USE OF S-CLENBUTEROL EUCRO EUROPEAN CONTRACT RESEARCH GMBH & CO. KG (DE) 2006-08-10 WO disclosed
EP-0114043-B1 DYE MIXTURES AND THEIR USE IN THE DYEING OF PAPER BAYER AG (DE) 1986-09-10 EP disclosed
US-4521217-A BLUE COLOR BAYER AKTIENGESELLSCHAFT (DE) 1985-06-04 US disclosed
EP-0114043-A2 Dye mixtures and their use in the dyeing of paper BAYER AG (DE) 1984-07-25 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-20100240764-A1 Use of S-Clenbuterol CHRNB2, CHRNB3, CHRNB4 HPGD 1122/4885MYC 4851/4885ERCC5 4104/4885

“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.