SCHEMBL2579101

SCHEMBL2579101

COc1ccc(Cc2cc(C)ccc2O)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
RAB9A P51151 1/20 0.49
IGF1R P08069 1/20 0.49
ALOX15 P16050 1/20 0.49
ALOX5 P09917 2/20 0.46
LTA4H P09960 1/20 0.46
IDH1 O75874 1/20 0.46
ACHE P22303 1/20 0.45
KLF10 Q13118 1/20 0.45
SLC5A1 P13866 1/20 0.44
CALM1 P0DP23 1/20 0.44

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
SCHEMBL2580796 0.88 IGF1R (0.53) MAPTIGF1RALOX15LTA4HCALM1
SCHEMBL31294095 0.88 AMY1A (0.68) AMY1AMAPTIGF1RALOX15
SCHEMBL11097682 0.85 CALM1 (0.51) NPC1RAB9AIGF1RALOX15LTA4H
SCHEMBL14283892 0.84 LTA4H (0.53) MAPTIGF1RALOX15LTA4HCALM1
SCHEMBL22500084 0.82 AMY1A (0.61) AMY1AL3MBTL1MAPTMAPK1IGF1R
SCHEMBL2576239 0.82 IGF1R (0.47) NPC1MAPTRAB9AIGF1RALOX15
SCHEMBL11286798 0.81 CNR2 (0.50) L3MBTL1NPC1MAPTRAB9ALTA4H
SCHEMBL4809365 0.81 AMY1A (0.59) AMY1AMAPTIGF1RALOX15SLC5A1
SCHEMBL15325999 0.80 SLC5A2 (0.51) LTA4HACHESLC5A1
SCHEMBL9657960 0.80 LTA4H (0.46) NPC1RAB9ALTA4HIDH1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8048897-B2 Cyclohexane derivative, prodrug thereof and salt thereof, and therapeutic agent containing the same for diabetes CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-11-01 US disclosed
CN-101010276-B Cyclohexane derivative, prodrug thereof, salt thereof, and therapeutic agent for diabetes containing same CHUGAI PHARMACEUTICAL CO LTD 2011-01-12 CN disclosed
US-20080318874-A1 Novel Cyclohexane Derivative, Prodrug Thereof and Salt Thereof, and Therapeutic Agent Containing the Same for Diabetes CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-12-25 US disclosed
CN-101010276-A Novel cyclohexane derivative, prodrug thereof, salt thereof, and therapeutic agent for diabetes containing the same CHUGAI PHARMACEUTICAL CO LTD (JP) 2007-08-01 CN disclosed
EP-1783110-A1 NOVEL CYCLOHEXANE DERIVATIVE, PRODRUG THEREOF AND SALT THEREOF, AND THERAPEUTIC AGENT CONTAINING THE SAME FOR DIABETES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-05-09 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-20080318874-A1 Novel Cyclohexane Derivative, Prodrug Thereof and Salt Thereof, and Therapeutic Agent Containing the Same for Diabetes SLC5A1, GPR119, SLC5A2 AMY1A 74/4885L3MBTL1 1828/4885NPC1 244/4885

“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.