SCHEMBL3639753

SCHEMBL3639753

COc1ccc(Cl)cc1C(=O)Nc1nc2c(s1)OCCC2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.54
▸ KCNMA1 Q12791 3/20 0.53
▸ KDM4E B2RXH2 4/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ HPGD P15428 2/20 0.52
▸ HSD17B10 Q99714 2/20 0.52
▸ NPSR1 Q6W5P4 2/20 0.52
▸ GAA P10253 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.52
▸ NPC1 O15118 4/20 0.51
▸ TP53 P04637 3/20 0.50
▸ LMNA P02545 1/20 0.50
▸ RAB9A P51151 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ CFTR P13569 2/20 0.47
▸ POLB P06746 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ DCLK1 O15075 1/20 0.46
▸ FES P07332 1/20 0.46
▸ PIM1 P11309 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
SCHEMBL3384688 0.83 MAPT (0.70) MAPTKCNMA1KDM4EALDH1A1HPGD
SCHEMBL3643014 0.80 MAPT (0.58) MAPTKCNMA1KDM4EALDH1A1HPGD
SCHEMBL945302 0.78 MAPT (0.52) MAPTKCNMA1KDM4EALDH1A1HPGD
SCHEMBL945105 0.72 RAB9A (0.71) MAPTKCNMA1KDM4EALDH1A1HPGD
SCHEMBL4916732 0.72 NPC1 (0.74) MAPTKCNMA1KDM4EALDH1A1HPGD
SCHEMBL944850 0.72 KCNMA1 (0.57) MAPTKCNMA1KDM4EALDH1A1HPGD
SCHEMBL345091 0.72 KCNMA1 (0.67) MAPTKCNMA1KDM4EALDH1A1HPGD
SCHEMBL3384383 0.71 KCNMA1 (0.54) MAPTKCNMA1KDM4EALDH1A1HPGD
SCHEMBL4898350 0.71 MAPT (0.53) MAPTKCNMA1KDM4EALDH1A1HPGD
SCHEMBL3387532 0.71 KCNMA1 (0.56) MAPTKCNMA1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735434-B2 Compounds as cannabinoid receptor ligands ABBVIE INC. (US) 2014-05-27 — — US disclosed
EP-2160393-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS Abbott Laboratories (US) 2010-03-10 — — EP disclosed
WO-2008144360-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-11-27 — — WO disclosed
US-20080287510-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-11-20 — — 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 (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-20080287510-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 MAPT 1735/4885KCNMA1 1416/4885KDM4E 1348/4885

“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.

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