SCHEMBL1127977

SCHEMBL1127977

COC(=O)c1sccc1-n1cccc1C(=O)C(=O)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.69
MAPT P10636 4/20 0.54
LMNA P02545 2/20 0.54
TDP1 Q9NUW8 1/20 0.52
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
CYP3A4 P08684 2/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
NPC1 O15118 3/20 0.43
RAB9A P51151 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
TP53 P04637 2/20 0.42
AHSA1 O95433 1/20 0.42
GAA P10253 3/20 0.42

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
SCHEMBL1127087 0.90 L3MBTL1 (0.55) L3MBTL1MAPTLMNAALDH1A1MEN1
SCHEMBL1126369 0.89 L3MBTL1 (0.80) L3MBTL1MAPTLMNATDP1ALDH1A1
SCHEMBL1126545 0.82 L3MBTL1 (1.00) L3MBTL1MAPTLMNATDP1ALDH1A1
SCHEMBL1127288 0.81 L3MBTL1 (0.66) L3MBTL1MAPTLMNATDP1ALDH1A1
SCHEMBL1126436 0.80 L3MBTL1 (0.81) L3MBTL1MAPTLMNATDP1ALDH1A1
SCHEMBL1126417 0.80 L3MBTL1 (0.81) L3MBTL1MAPTLMNATDP1ALDH1A1
SCHEMBL1127017 0.75 RAB9A (0.64) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL1126455 0.74 L3MBTL1 (0.64) L3MBTL1MAPTLMNATDP1ALDH1A1
SCHEMBL1126500 0.72 CYP3A4 (0.80) L3MBTL1MAPTLMNATDP1ALDH1A1
SCHEMBL12293608 0.68 PARP14 (0.54) MAPTLMNACYP3A4CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2283006-B1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2015-02-25 EP 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
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 L3MBTL1 1045/4885MAPT 1696/4885LMNA 3641/4885
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 L3MBTL1 1045/4885MAPT 1696/4885LMNA 3641/4885

“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.