SCHEMBL432035

SCHEMBL432035

C/C=C/C=C/C=C/CCCCCCCCCCC

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
ALDH1A1 P00352 1/20 0.61
FASN P49327 1/20 0.53
FAAH O00519 5/20 0.48
TRPV1 Q8NER1 1/20 0.48
KDM4E B2RXH2 1/20 0.44
SOAT1 P35610 1/20 0.44
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 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
SCHEMBL5688911 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1
SCHEMBL16149412 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1
SCHEMBL29403468 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1
SCHEMBL5688908 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1
SCHEMBL3423312 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1
SCHEMBL10538624 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1
SCHEMBL20866020 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1
SCHEMBL21638328 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1
SCHEMBL20866021 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1
SCHEMBL16149413 1.00 TSHR (0.61) TSHRALDH1A1FASNFAAHTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2507221-A1 SHIP1 MODULATORS AND METHODS RELATED THERETO Aquinox Pharmaceuticals Inc. (CA) 2012-10-10 EP disclosed
US-8101605-B2 SHIP1 modulators and methods related thereto AQUINOX PHARMACEUTICALS INC. (CA) 2012-01-24 US disclosed
WO-2011069118-A1 SHIP1 MODULATORS AND METHODS RELATED THERETO AQUINOX PHARMACEUTICALS INC. (CA) 2011-06-09 WO disclosed
US-20110136802-A1 SHIP1 MODULATORS AND METHODS RELATED THERETO AQUINOX PHARMACEUTICALS INC. (CA) 2011-06-09 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-20110136802-A1 SHIP1 MODULATORS AND METHODS RELATED THERETO PPM1D, PTPRO, PPM1G TSHR 1013/4885ALDH1A1 1441/4885FASN 4622/4885

“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.