SCHEMBL1127002

SCHEMBL1127002

Cc1cc(-c2ccccc2)c(C(=O)C(=O)Nc2ccc(N3CCN(CC(C)(C)C)CC3)cc2F)n1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.40
TSHR P16473 2/20 0.39
MAPT P10636 4/20 0.38
FGFR1 P11362 1/20 0.38
FGFR2 P21802 1/20 0.38
KDR P35968 1/20 0.38
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
SLC6A4 P31645 1/20 0.37
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ATM Q13315 2/20 0.36
GLA P06280 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
REV1 Q9UBZ9 1/20 0.36
DRD4 P21917 2/20 0.35
DRD2 P14416 1/20 0.35
DRD3 P35462 1/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL1126921 0.89 MAPT (0.37) ARTSHRMAPTFGFR1FGFR2
SCHEMBL1126560 0.88 SIGMAR1 (0.40) TSHRMAPTFGFR1FGFR2KDR
SCHEMBL1126468 0.88 TSHR (0.39) TSHRMAPTFGFR1FGFR2KDR
SCHEMBL1126750 0.86 GAA (0.37) MAPTNPSR1TDP1ALDH1A1RAB9A
SCHEMBL1126781 0.85 TSHR (0.38) ARTSHRMAPTHTR2AHTR2C
SCHEMBL1992161 0.85 MAPT (0.44) MAPTLMNANPSR1TDP1MEN1
SCHEMBL1127042 0.83 POLB (0.45) TSHRMAPTLMNAHPGDNPSR1
SCHEMBL30234914 0.83 POLB (0.45) TSHRMAPTLMNAHPGDNPSR1
SCHEMBL1126928 0.78 MAPT (0.39) TSHRMAPTHTR2AHTR2CSLC6A4
SCHEMBL1126522 0.78 MAPT (0.37) MAPTLMNAATMRAB9AP2RY1

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 13 patents. 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
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
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 (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 AR 2125/4885TSHR 1769/4885MAPT 1696/4885
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 AR 2125/4885TSHR 1769/4885MAPT 1696/4885

“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.