SCHEMBL16859999

SCHEMBL16859999

[C]=CC=CCCCCCCCCCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
ALDH1A1 P00352 1/20 0.52
FAAH O00519 3/20 0.50
TRPV1 Q8NER1 1/20 0.50
FASN P49327 1/20 0.50
TERT O14746 3/20 0.43
MAPT P10636 2/20 0.43
BLM P54132 2/20 0.43
HSD17B10 Q99714 2/20 0.43
FABP4 P15090 2/20 0.43
PTPN1 P18031 2/20 0.43
PPARG P37231 2/20 0.43
PPARD Q03181 2/20 0.43
PPARA Q07869 2/20 0.43
GMNN O75496 1/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL16859972 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN
SCHEMBL16859992 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN
SCHEMBL16859981 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN
SCHEMBL16859980 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN
SCHEMBL16859968 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN
SCHEMBL16860002 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN
SCHEMBL16859973 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN
SCHEMBL16859969 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN
SCHEMBL16859993 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN
SCHEMBL16859985 1.00 TSHR (0.52) TSHRALDH1A1FAAHTRPV1FASN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3089584-A1 AGRICULTURAL PESTICIDE COMPOSITIONS Rhodia Operations (FR) 2016-11-09 EP disclosed
WO-2015103192-A1 AGRICULTURAL PESTICIDE COMPOSITIONS RHODIA OPERATIONS (FR) 2015-07-09 WO disclosed
US-20150181862-A1 AGRICULTURAL PESTICIDE COMPOSITIONS RHODIA OPERATIONS (FR) 2015-07-02 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-20150181862-A1 AGRICULTURAL PESTICIDE COMPOSITIONS PLD2, PLD1, ADH1C TSHR 1602/4885ALDH1A1 866/4885FAAH 47/4885

“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.