SCHEMBL1126695

SCHEMBL1126695

Cc1cc(C)nc(N2CCN(c3ccc(NC(=O)C(=O)c4c(-c5ccccc5)cc(C)n4C)cc3C)CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 2/20 0.41
MAPT P10636 11/20 0.39
TP53 P04637 7/20 0.39
LMNA P02545 9/20 0.39
THRB P10828 1/20 0.39
HTT P42858 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KIT P10721 1/20 0.37
PDGFRA P16234 1/20 0.37
KDR P35968 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HSP90AA1 P07900 1/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 2/20 0.36
APOBEC3A P31941 1/20 0.36
RAD52 P43351 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL30234686 0.92 MAPT (0.37) NPY2RMAPTTP53LMNATHRB
SCHEMBL1126444 0.92 NPC1 (0.41) NPY2RMAPTTP53LMNAHTT
SCHEMBL1127148 0.92 MAPT (0.37) NPY2RMAPTTP53LMNATHRB
SCHEMBL23488118 0.90 MAPT (0.35) NPY2RMAPTTP53LMNATHRB
SCHEMBL30234731 0.89 MAPT (0.42) MAPTTP53LMNAHTTALDH1A1
SCHEMBL1127284 0.89 MAPT (0.42) MAPTTP53LMNAHTTALDH1A1
SCHEMBL1645685 0.87 MAPT (0.53) NPY2RMAPTTP53LMNATHRB
SCHEMBL1989247 0.86 MAPT (0.40) MAPTTP53LMNAALDH1A1MEN1
SCHEMBL942509 0.85 NPY2R (0.38) NPY2RMAPTTP53LMNATHRB
SCHEMBL1647462 0.85 MAPT (0.51) NPY2RMAPTLMNATHRBHTT

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9452168-B2 Pyrrole antifungal agents F2G LTD (GB) 2016-09-27 US claimed
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2015-08-27 US claimed
US-8993574-B2 Pyrrole antifungal agents F2G LTD (GB) 2015-03-31 US claimed
US-20110152285-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2011-06-23 US claimed
EP-2283006-A1 PYRROLE ANTIFUNGAL AGENTS F2G Limited (GB) 2011-02-16 EP claimed
WO-2009130481-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2009-10-29 WO claimed
CN-111096967-B Antifungal agent F2G有限公司 2023-03-10 CN disclosed
US-11065228-B2 Antifungal agents F2G LIMITED (GB) 2021-07-20 US disclosed
US-20200179340-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2020-06-11 US disclosed
CN-111096967-A Antifungal agent F2G有限公司 2020-05-05 CN disclosed
US-10596150-B2 Antifungal agents F2G LIMITED (GB) 2020-03-24 US disclosed
US-20190314333-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2019-10-17 US disclosed
US-10201524-B2 Antifungal agents F2G LIMITED (GB) 2019-02-12 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
EP-2283006-A1 PYRROLE ANTIFUNGAL AGENTS F2G Limited (GB) 2011-02-16 EP disclosed
WO-2009130481-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2009-10-29 WO 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 (7 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-20200179340-A1 ANTIFUNGAL AGENTS DPM1, AADAC, PIK3C3 NPY2R 1802/4885MAPT 3096/4885TP53 2655/4885
US-20110152285-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 NPY2R 1755/4885MAPT 1696/4885TP53 1227/4885
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 NPY2R 1755/4885MAPT 1696/4885TP53 1227/4885
US-11065228-B2 Antifungal agents DPM1, AADAC, PIK3C3 NPY2R 1802/4885MAPT 3096/4885TP53 2655/4885
US-20190314333-A1 ANTIFUNGAL AGENTS DPM1, AADAC, PIK3C3 NPY2R 1802/4885MAPT 3096/4885TP53 2655/4885
US-10201524-B2 Antifungal agents DPM1, AADAC, PIK3C3 NPY2R 1802/4885MAPT 3096/4885TP53 2655/4885
US-10596150-B2 Antifungal agents DPM1, AADAC, PIK3C3 NPY2R 1802/4885MAPT 3096/4885TP53 2655/4885

“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.