SCHEMBL7046008

SCHEMBL7046008

Cc1ccc([CH]c2ccc(C)c(C)c2C)c(C)c1C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP1A2 P05177 2/20 0.33
CYP2A6 P11509 1/20 0.33
TSHR P16473 1/20 0.33
TDP2 O95551 1/20 0.33
NSD2 O96028 1/20 0.33
HSP90AA1 P07900 1/20 0.33
PAX8 Q06710 1/20 0.33
POLB P06746 1/20 0.31
TRPA1 O75762 1/20 0.31
ATM Q13315 1/20 0.31

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
SCHEMBL1613096 0.80 KDM4E (0.34) KDM4EMAPTMAPK1CYP1A2CYP2A6
SCHEMBL366594 0.78 ALDH1A1 (0.48) KDM4EMAPTCYP1A2CYP2A6TSHR
SCHEMBL57999 0.78 MAPT (0.33) KDM4EMAPTMAPK1CYP1A2CYP2A6
SCHEMBL3514534 0.78 KDM4E (0.33) KDM4EMAPTMAPK1CYP1A2CYP2A6
SCHEMBL16957541 0.78 KDM4E (0.38) KDM4EMAPTMAPK1CYP1A2CYP2A6
SCHEMBL5494672 0.77 TSHR (0.45) KDM4EMAPTMAPK1CYP1A2CYP2A6
SCHEMBL37955 0.77 TSHR (0.45) KDM4EMAPTMAPK1CYP1A2CYP2A6
SCHEMBL1611471 0.76 KDM4E (0.32) KDM4EMAPTMAPK1CYP1A2CYP2A6
SCHEMBL3306781 0.74 TRPA1 (0.46) KDM4EMAPTCYP1A2CYP2A6TSHR
Hydrochloric Acid SCHEMBL11018653 0.74 KDM4E (0.31) KDM4EMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030176448-A1 Mitochondria protecting agents for treating mitochondria associated diseases MITOKOR (US) 2003-09-18 US disclosed
US-6511966-B2 Administering for therapy of mitochondria medited disease MITOKOR 2003-01-28 US disclosed
US-6498191-B2 FOR TREATMENT OF ALZHEIMER'S DISEASE, DIABETES MELLITUS, PARKINSON'S DISEASE, NEURONAL AND CARDIAC ISCHEMIA, HUNTINGTON'S DISEASE, STROKE MITOKOR 2002-12-24 US disclosed
EP-1222920-A2 Mitochondria protecting agents for treating mitochondria associated diseases MITOKOR (US) 2002-07-17 EP disclosed
US-20020068750-A1 Mitochondria protecting agents for treating mitochondria associated diseases GHOSH SOUMITRA S (US) 2002-06-06 US disclosed
US-20020065298-A1 Mitochondria protecting agents for treating mitochondria associated diseases GHOSH SOUMITRA S (US) 2002-05-30 US disclosed
US-20020065299-A1 Mitochondria protecting agents for treating mitochondria associated diseases GHOSH SOUMITRA S (US) 2002-05-30 US disclosed
US-20020010195-A1 Mitochondria protecting agents for treating mitochondria associated diseases GHOSH SOUMITRA S (US) 2002-01-24 US disclosed
EP-1051165-A2 MITOCHONDRIA PROTECTING AGENTS FOR TREATING MITOCHONDRIA ASSOCIATED DISEASES Mitokor (US) 2000-11-15 EP disclosed
WO-1999037294-A2 MITOCHONDRIA PROTECTING AGENTS FOR TREATING MITOCHONDRIA ASSOCIATED DISEASES MITOKOR (US) 1999-07-29 WO 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 (5 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-20020065298-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 KDM4E 4364/4885MAPT 284/4885MAPK1 3521/4885
US-20030176448-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 KDM4E 4356/4885MAPT 283/4885MAPK1 3540/4885
US-20020068750-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 KDM4E 4384/4885MAPT 285/4885MAPK1 3548/4885
US-20020010195-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 KDM4E 4364/4885MAPT 284/4885MAPK1 3521/4885
US-20020065299-A1 Mitochondria protecting agents for treating mitochondria associated diseases TFAM, HSPA9, HSPD1 KDM4E 4366/4885MAPT 284/4885MAPK1 3496/4885

“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.