SCHEMBL1992166

SCHEMBL1992166

Cc1cc(C)nc(N(C)CCCc2ccc(NC(=O)C(=O)c3c(-c4cccs4)cc(C)n3C)cc2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.34
KDM4E B2RXH2 4/20 0.33
NR1H4 Q96RI1 2/20 0.32
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32
NTRK1 P04629 2/20 0.32
MAPT P10636 2/20 0.32
TP53 P04637 2/20 0.32
NTRK2 Q16620 1/20 0.32
KLK7 P49862 1/20 0.32
THRB P10828 1/20 0.32
TSHR P16473 2/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CDK1 P06493 1/20 0.32
KDR P35968 1/20 0.32
ALDH1A1 P00352 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
POLB P06746 2/20 0.32
NPC1 O15118 1/20 0.31

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
SCHEMBL1990917 0.93 GAA (0.34) GAAKDM4EKMT2AMEN1MAPT
SCHEMBL1990146 0.91 GAA (0.35) GAAKDM4EKMT2AMEN1MAPT
SCHEMBL1989974 0.90 GAA (0.35) GAAKDM4EKMT2AMEN1MAPT
SCHEMBL1127212 0.88 MCHR1 (0.37) KMT2AMEN1NTRK1MAPTNTRK2
SCHEMBL1988892 0.87 MAPT (0.35) GAAKDM4EKMT2AMEN1MAPT
SCHEMBL1993708 0.81 ALDH1A1 (0.36) GAAKDM4EKMT2AMEN1MAPT
SCHEMBL1993613 0.81 LMNA (0.37) KDM4EKMT2AMEN1MAPTTHRB
SCHEMBL1992483 0.79 KDM4E (0.41) GAAKDM4EKMT2AMEN1MAPT
SCHEMBL1988907 0.79 LMNA (0.38) KDM4EKMT2AMEN1MAPTTHRB
SCHEMBL1126673 0.78 LMNA (0.37) KDM4EKMT2AMEN1MAPTTHRB

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 6 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-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 GAA 554/4885KDM4E 1706/4885NR1H4 4147/4885
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 GAA 554/4885KDM4E 1706/4885NR1H4 4147/4885

“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.