SCHEMBL1989501

SCHEMBL1989501

CCOC(=O)c1c[nH]cc1-c1ccsc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
USP2 O75604 1/20 0.56
MAPT P10636 1/20 0.56
ALOX15 P16050 1/20 0.56
CHEK2 O96017 1/20 0.53
CDC7 O00311 1/20 0.49
DBF4 Q9UBU7 1/20 0.49
ADORA2B P29275 5/20 0.44
ALDH1A1 P00352 3/20 0.44
POLB P06746 2/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
GAA P10253 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 2/20 0.44

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
SCHEMBL15028901 0.84 HSD17B10 (0.60) HSD17B10MEN1KMT2AUSP2MAPT
SCHEMBL2673120 0.79 ALDH1A1 (0.50) HSD17B10MEN1KMT2AMAPTALDH1A1
SCHEMBL4042415 0.79 TSHR (0.58) HSD17B10MEN1KMT2AMAPTALOX15
SCHEMBL15025426 0.79 HSD17B10 (0.55) HSD17B10MEN1KMT2AUSP2MAPT
SCHEMBL12050153 0.78 MAPT (0.54) HSD17B10MEN1KMT2AUSP2MAPT
SCHEMBL1126765 0.77 ACMSD (0.50) KMT2ACHEK2ALDH1A1
SCHEMBL8665022 0.77 PRKCZ (0.52) HSD17B10MEN1KMT2AMAPTALDH1A1
SCHEMBL6164247 0.77 HTT (0.50) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL4491165 0.77 ALDH1A1 (0.55) HSD17B10MEN1KMT2AMAPTALOX15
SCHEMBL6976375 0.77 TSHR (0.46) HSD17B10MEN1KMT2AMAPTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9452168-B2 Pyrrole antifungal agents F2G LTD (GB) 2016-09-27 US disclosed
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2015-08-27 US disclosed
US-8993574-B2 Pyrrole antifungal agents F2G LTD (GB) 2015-03-31 US disclosed
EP-2283006-B1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2015-02-25 EP disclosed
EP-2626361-B1 Pyrrole antifungal agents F2G LTD (GB) 2014-10-15 EP disclosed
EP-2626361-A1 Pyrrole antifungal agents F2G Limited (GB) 2013-08-14 EP disclosed
US-20110152285-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2011-06-23 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 (2 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-20110152285-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 HSD17B10 2503/4885MEN1 77/4885KMT2A 3996/4885
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 HSD17B10 2503/4885MEN1 77/4885KMT2A 3996/4885

“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.