SCHEMBL17833498

SCHEMBL17833498

Cc1ccccc1/C=C/C(=O)N(C)O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.47
ALOX5 P09917 3/20 0.47
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
ALDH1A1 P00352 2/20 0.44
TSHR P16473 2/20 0.44
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GMNN O75496 1/20 0.43
LMNA P02545 1/20 0.43
PMP22 Q01453 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
THPO P40225 1/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL3732406 0.87 TRPM8 (0.48) TRPM8ALOX5ALDH1A1TSHRRAB9A
SCHEMBL19954281 0.87 TRPM8 (0.48) TRPM8ALOX5ALDH1A1TSHRRAB9A
SCHEMBL13697272 0.81 ALOX5 (0.46) TRPM8ALOX5PTGS1PTGS2LMNA
SCHEMBL28379416 0.79 NPC1 (0.63) TRPM8ALDH1A1TSHRRAB9AKDM4E
SCHEMBL5598952 0.79 NFE2L2 (0.61) ALDH1A1TSHRRAB9AKDM4EGMNN
SCHEMBL5598954 0.79 NFE2L2 (0.61) ALDH1A1TSHRRAB9AKDM4EGMNN
SCHEMBL3363365 0.78 ALOX5 (0.73) TRPM8ALOX5PTGS1PTGS2
SCHEMBL9877248 0.78 HDAC8 (0.58) ALDH1A1RAB9AKDM4ELMNASMN1; SMN2
SCHEMBL3363362 0.78 ALOX5 (0.73) TRPM8ALOX5PTGS1PTGS2
SCHEMBL9791099 0.78 BACE1 (0.50) ALOX5PTGS1PTGS2SMN1; SMN2

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-20160166508-A1 Method and Composition for Treating Inflammatory Disorders MEDA AB (SE) 2016-06-16 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-20160166508-A1 Method and Composition for Treating Inflammatory Disorders LIPA, HRH2, HRH1 TRPM8 1059/4885ALOX5 25/4885PTGS1 76/4885

“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.