SCHEMBL1620932

SCHEMBL1620932

C=Cc1c(F)ccc(OC)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 8/20 0.46
TRPA1 O75762 1/20 0.41
LMNA P02545 2/20 0.39
MAPK1 P28482 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TUBB1 Q9H4B7 2/20 0.38
AMY1A P0DUB6 1/20 0.38
TLR2 O60603 1/20 0.37
TLR1 Q15399 1/20 0.37
TLR6 Q9Y2C9 1/20 0.37
HTT P42858 1/20 0.36
RAB9A P51151 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
SCHEMBL1477693 0.81 ERN1 (0.64) ERN1ALDH1A1HPGDTLR2TLR1
SCHEMBL28892227 0.77 TUBB1 (0.41) TRPA1LMNAMAPK1ALDH1A1TUBB1
SCHEMBL4302346 0.74 MAPK1 (0.46) ERN1LMNAMAPK1MAPTKDM4E
SCHEMBL14569369 0.73 NFE2L2 (0.47) LMNAMAPK1MAPTKDM4EALDH1A1
SCHEMBL8823701 0.70 ERN1 (0.54) ERN1ALDH1A1HPGDTLR2TLR1
SCHEMBL29958418 0.70 ERN1 (0.54) ERN1ALDH1A1HPGDTLR2TLR1
SCHEMBL1065689 0.70 TUBB1 (0.43) ERN1LMNAMAPK1MAPTKDM4E
SCHEMBL69957 0.70 MAPT (0.62) ERN1LMNAMAPK1MAPTKDM4E
SCHEMBL1620718 0.69 TUBB1 (0.30) TUBB1
SCHEMBL14882573 0.69 MAPT (0.50) ERN1LMNAMAPK1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2194046-B1 Triazolone derivative EISAI R&D MAN CO LTD (JP) 2012-05-09 EP disclosed
US-8163787-B2 Triazolone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-24 US disclosed
US-20110112109-A1 TRIAZOLONE DERIVATIVES CLARK RICHARD 2011-05-12 US disclosed
US-7928228-B2 Triazolone derivatives EISAI CO., LTD. (JP) 2011-04-19 US disclosed
US-7816522-B2 Triazolone derivatives EISAI CO., LTD. (JP) 2010-10-19 US disclosed
US-20100190783-A1 TRIAZOLONE DERIVATIVES CLARK RICHARD 2010-07-29 US disclosed
EP-2194046-A1 Triazolone derivative Eisai R&D Management Co., Ltd. (JP) 2010-06-09 EP disclosed
EP-2000465-A1 TRIAZOLONE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2008-12-10 EP disclosed
US-20080015199-A1 Triazolone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-01-17 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 (3 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-20100190783-A1 TRIAZOLONE DERIVATIVES H1-0, H1-10, H1-2 ERN1 1354/4885TRPA1 1171/4885LMNA 2146/4885
US-20110112109-A1 TRIAZOLONE DERIVATIVES H1-10, H1-0, H1-2 ERN1 1512/4885TRPA1 978/4885LMNA 1872/4885
US-20080015199-A1 Triazolone derivatives F3, F12, F2 ERN1 1107/4885TRPA1 1969/4885LMNA 1245/4885

“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.