SCHEMBL477818

SCHEMBL477818

CN1CC[C@H](Oc2ccc(C(F)(F)F)cc2C(=O)O)C1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 16/20 0.54
LIPC P11150 4/20 0.54
CNR2 P34972 1/20 0.54
LPL P06858 3/20 0.53
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
USP2 O75604 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
HSD17B10 Q99714 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
SCHEMBL477819 1.00 LIPG (0.54) LIPGLIPCCNR2LPLKDM4E
SCHEMBL3713690 0.89 CNR2 (0.54) LIPGLIPCCNR2LPLKDM4E
SCHEMBL6823927 0.83 CNR2 (0.48) LIPGLIPCCNR2LPLKDM4E
Hydrochloric Acid SCHEMBL5743521 0.82 CNR2 (0.47) LIPGLIPCCNR2LPLKDM4E
SCHEMBL10369755 0.78 CHRM3 (0.55) KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL477885 0.77 IKBKE (0.45) CNR2KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL477884 0.77 IKBKE (0.45) CNR2KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL10370253 0.76 ALDH1A1 (0.52) KDM4EALDH1A1SMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL5743525 0.76 UTS2R (0.44) CNR2KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL5743805 0.76 UTS2R (0.52) KDM4EALDH1A1MAPTSMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9193713-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2015-11-24 US disclosed
EP-2851366-A1 Compounds as cannabinoid receptor ligands Abbvie Inc. (US) 2015-03-25 EP disclosed
US-8492371-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2013-07-23 US disclosed
EP-2411382-A1 COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS Abbott Laboratories (US) 2012-02-01 EP disclosed
US-20100249129-A1 COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2010-09-30 US disclosed
WO-2010111572-A1 COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2010-09-30 WO disclosed
US-20090105306-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-04-23 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-20090105306-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 LIPG 1563/4885LIPC 986/4885CNR2 2/4885
US-20100249129-A1 COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 LIPG 964/4885LIPC 653/4885CNR2 2/4885

“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.