SCHEMBL13183083

SCHEMBL13183083

CCCCOc1cccc(-c2cccc(C(O)c3nnc(C)o3)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ CTSA P10619 13/20 0.47
▸ ALOX5 P09917 1/20 0.47
▸ CYP1A2 P05177 1/20 0.46
▸ CYP19A1 P11511 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 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
SCHEMBL12746073 0.76 CTSA (0.51) SMN1; SMN2LMNAHPGDALOX15TSHR
SCHEMBL1172432 0.76 CTSA (0.51) SMN1; SMN2LMNAHPGDALOX15TSHR
SCHEMBL12879201 0.74 CYP1A2 (0.48) SMN1; SMN2CYP1A2CYP19A1CYP2C9CYP2C19
SCHEMBL12826507 0.73 NR1H4 (0.51) SMN1; SMN2MAPK1CYP1A2CYP19A1CYP2C9
SCHEMBL197506 0.73 CYP19A1 (0.64) SMN1; SMN2TSHRCYP1A2CYP19A1CYP2C9
SCHEMBL14347947 0.69 ALOX5 (0.53) TSHRALOX5
SCHEMBL12653028 0.69 LTA4H (0.61) SMN1; SMN2TSHRCYP1A2CYP19A1CYP2C9
SCHEMBL21834297 0.69 MAOB (0.39) SMN1; SMN2LMNAHPGDALOX15TSHR
SCHEMBL21834242 0.69 MAOB (0.39) SMN1; SMN2LMNAHPGDALOX15TSHR
SCHEMBL14066695 0.68 CACNA1B (0.53) SMN1; SMN2LMNATSHRALOX5

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-9102622-B2 Fatty acid amide hydrolase inhibitors UNIVERSITY OF CONNECTICUT (US) 2015-08-11 — — US disclosed
US-20100234379-A1 Dual modulation of endocannabinoid transport and fatty-acid amide hydrolase for treatment of excitotoxicity CONNECTICUT, UNIVERSITY OF 2010-09-16 — — US disclosed
US-20090306016-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS UNIVERSITY OF CONNECTICUT 2009-12-10 — — US disclosed
WO-2009052320-A1 METHODS AND COMPOUNDS FOR MODULATING CANNABINOID ACTIVITY NORTHEASTERN UNIVERSITY (US) 2009-04-23 — — WO disclosed
WO-2009052319-A1 MONOACYLGLYCEROL LIPASE INHIBITORS FOR MODULATION OF CANNABINOID ACTIVITY NORTHEASTERN UNIVERSITY (US) 2009-04-23 — — 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 (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-20090306016-A1 FATTY ACID AMIDE HYDROLASE INHIBITORS FAAH, FAAH2, CNR2 SMN1; SMN2 4824/4885LMNA 4375/4885HPGD 524/4885
US-20100234379-A1 Dual modulation of endocannabinoid transport and fatty-acid amide hydrolase for treatment of excitotoxicity FAAH, FAAH2, CNR2 SMN1; SMN2 3355/4885LMNA 3975/4885HPGD 1848/4885

“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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