SCHEMBL13356402

SCHEMBL13356402

CC(C)=CCC/C(C)=C/CC/C(C)=C/CCc1ccccc1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICMT O60725 2/20 0.62
GMNN O75496 1/20 0.62
TRPA1 O75762 1/20 0.62
LMNA P02545 1/20 0.62
CYP1A2 P05177 1/20 0.62
POLB P06746 1/20 0.62
CYP3A4 P08684 1/20 0.62
MAPT P10636 1/20 0.62
CYP2C9 P11712 1/20 0.62
TSHR P16473 1/20 0.62
NFKB1 P19838 1/20 0.62
CDK2 P24941 1/20 0.62
RECQL P46063 1/20 0.62
BLM P54132 1/20 0.62
HIF1A Q16665 1/20 0.62
HSD17B10 Q99714 1/20 0.62
TRPV1 Q8NER1 2/20 0.50
GGPS1 O95749 2/20 0.50
FOLH1 Q04609 1/20 0.47
CNR2 P34972 1/20 0.46

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
SCHEMBL22230549 0.91 FOLH1 (0.56) ICMTGMNNTRPA1LMNACYP1A2
SCHEMBL15345638 0.89 MAPT (0.62) ICMTGMNNTRPA1LMNACYP1A2
SCHEMBL28036 0.87 MAPT (0.60) ICMTGMNNTRPA1LMNACYP1A2
SCHEMBL28035 0.87 MAPT (0.60) ICMTGMNNTRPA1LMNACYP1A2
SCHEMBL5604693 0.87 MAPT (0.60) ICMTGMNNTRPA1LMNACYP1A2
SCHEMBL17076517 0.80 ICMT (0.58) ICMTGMNNTRPA1LMNACYP1A2
SCHEMBL30392397 0.80 ICMT (0.58) ICMTGMNNTRPA1LMNACYP1A2
SCHEMBL3270847 0.78 ICMT (0.53) ICMTGMNNTRPA1LMNACYP1A2
Farnesol SCHEMBL6072528 0.78 MAPT (0.60) ICMTGMNNTRPA1LMNACYP1A2
SCHEMBL3270841 0.78 ICMT (0.53) ICMTGMNNTRPA1LMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140315834-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN THE PREVENTION AND TREATMENT OF INFLAMMATION-RELATED DISORDERS, PAIN AND FEVER, SKIN DISORDERS, CANCER AND PRECANCEROUS CONDITIONS THEREOF MEDICON PHARMACEUTICALS, INC. (US) 2014-10-23 US disclosed
EP-1778209-B1 METHODS AND COMPOSITIONS FOR ORAL DELIVERY OF FTS CONCORDIA PHARMACEUTICALS INC (US) 2010-05-05 EP 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-20140315834-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN THE PREVENTION AND TREATMENT OF INFLAMMATION-RELATED DISORDERS, PAIN AND FEVER, SKIN DISORDERS, CANCER AND PRECANCEROUS CONDITIONS THEREOF HMGB1, PTGES, FDPS ICMT 1880/4885GMNN 3724/4885TRPA1 14/4885

“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.