SCHEMBL2079088

SCHEMBL2079088

O=C(O)/C=C/C=C/c1ccc(Cl)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.55
ALDH1A1 P00352 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
KDM4E B2RXH2 2/20 0.55
GAA P10253 1/20 0.55
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
POLB P06746 1/20 0.51
PLA2G1B P04054 1/20 0.51
ATG4B Q9Y4P1 1/20 0.51
LMNA P02545 7/20 0.49
KMT2A Q03164 4/20 0.49
MAOB P27338 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 3/20 0.48
ITGB2 P05107 2/20 0.48
ICAM1 P05362 2/20 0.48
ITGAL P20701 2/20 0.48
TBXA2R P21731 1/20 0.48

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
SCHEMBL2079090 1.00 MAPT (0.55) MAPTALDH1A1L3MBTL1KDM4EGAA
SCHEMBL481451 0.87 MAPT (0.65) MAPTALDH1A1L3MBTL1KDM4EGAA
SCHEMBL29419102 0.87 MAPT (0.65) MAPTALDH1A1L3MBTL1KDM4EGAA
SCHEMBL165227 0.87 MAPT (0.65) MAPTALDH1A1L3MBTL1KDM4EGAA
SCHEMBL2082270 0.86 MAPT (0.55) MAPTALDH1A1L3MBTL1KDM4EGAA
SCHEMBL2082273 0.86 MAPT (0.55) MAPTALDH1A1L3MBTL1KDM4EGAA
Hydrochloric Acid SCHEMBL6822024 0.86 MAPT (0.63) MAPTALDH1A1L3MBTL1KDM4EGAA
Hydrochloric Acid SCHEMBL27093058 0.86 MAPT (0.63) MAPTALDH1A1L3MBTL1KDM4EGAA
SCHEMBL11459860 0.86 MAPT (0.63) MAPTALDH1A1L3MBTL1KDM4EGAA
SCHEMBL11454521 0.83 TDP1 (0.60) MAPTALDH1A1L3MBTL1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7897601-B2 Cannabinoid receptor modulators INTERVET, INC. (US) 2011-03-01 US disclosed
US-7897601-B2 Cannabinoid receptor modulators INTERVET, INC. (US) 2011-03-01 US disclosed
US-7897601-B2 Cannabinoid receptor modulators INTERVET, INC. (US) 2011-03-01 US disclosed
EP-1973877-A2 CANNIBINOID RECEPTOR MODULATORS SCHERING CORPORATION (US) 2008-10-01 EP disclosed
US-20070197628-A1 Cannabinoid receptor modulators INTERVET INTERNATIONAL B.V. (NL) 2007-08-23 US disclosed
US-20070197628-A1 Cannabinoid receptor modulators INTERVET INTERNATIONAL B.V. (NL) 2007-08-23 US disclosed
US-20070197628-A1 Cannabinoid receptor modulators INTERVET INTERNATIONAL B.V. (NL) 2007-08-23 US disclosed
WO-2007084450-A2 CANNIBINOID RECEPTOR MODULATORS SCHERING CORPORATION (US) 2007-07-26 WO disclosed
WO-2007084450-A2 CANNIBINOID RECEPTOR MODULATORS SCHERING CORPORATION (US) 2007-07-26 WO disclosed
US-6458806-B1 ANTIINFLAMMATORY AND -ARTHRITIC AGENTS, ATHEROSCLEROSIS, RESTENOSIS; TRANSPLANT REJECTION; INFLAMMATORY BOWEL DISEASES, CROHN'S DISEASE, ANTIALLERGENS; IMMUNE, SKIN GASTROINTESTINAL AND RESPIRATORY SYSTEM DIORDERS MILLENNIUM PHARMACEUTICALS, INC. 2002-10-01 US disclosed
US-20020028833-A1 ARYL ALKENAMIDES DERIVATIVES AS MCP-1 ANTAGONISTS MILLENNIUM PHARMACEUTICALS, INC. 2002-03-07 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 (2 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-20020028833-A1 ARYL ALKENAMIDES DERIVATIVES AS MCP-1 ANTAGONISTS CCR2, CCR1, MSR1 MAPT 4720/4885ALDH1A1 1447/4885L3MBTL1 1385/4885
US-20070197628-A1 Cannabinoid receptor modulators CNR1, CNR2, GPR18 MAPT 1582/4885ALDH1A1 1999/4885L3MBTL1 4053/4885

“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.