SCHEMBL3764362

SCHEMBL3764362

CCCC/C=C/CCOc1cccc(NC)c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
APP P05067 1/20 0.46
FAAH O00519 1/20 0.44
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
NR1H4 Q96RI1 2/20 0.41
PPARA Q07869 1/20 0.41
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40
SMPD1 P17405 3/20 0.40
TLR4 O00206 1/20 0.40
TLR2 O60603 1/20 0.40

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
SCHEMBL3658254 1.00 THRB (0.48) THRBAPPFAAHTSHRKMT2A
SCHEMBL3661681 0.91 APP (0.48) THRBAPPFAAHTSHRKMT2A
SCHEMBL3775410 0.91 APP (0.48) THRBAPPFAAHTSHRKMT2A
SCHEMBL28362681 0.90 TSHR (0.52) THRBAPPFAAHTSHRNR1H4
SCHEMBL28362683 0.90 TSHR (0.52) THRBAPPFAAHTSHRNR1H4
SCHEMBL3661810 0.90 APP (0.47) THRBAPPFAAHTSHRKMT2A
SCHEMBL3770836 0.90 APP (0.47) THRBAPPFAAHTSHRKMT2A
Hydrochloric Acid SCHEMBL28362695 0.89 TSHR (0.51) THRBAPPFAAHTSHRNR1H4
Hydrochloric Acid SCHEMBL28362704 0.89 TSHR (0.51) THRBAPPFAAHTSHRNR1H4
SCHEMBL3770949 0.89 APP (0.46) THRBAPPFAAHTSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100311790-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME SUMITOMO CHIEMCAL COMPANY LIMITED (JP) 2010-12-09 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 (1 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-20100311790-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME ATL3, NAT1, C5 THRB 2450/4885APP 2380/4885FAAH 19/4885

“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.