SCHEMBL1129006

SCHEMBL1129006

Cc1nc(-c2ccccc2)sc1B(O)OC(C)(C)C(C)(C)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.43
ALDH1A1 P00352 7/20 0.41
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAPT P10636 4/20 0.39
GAA P10253 1/20 0.39
LMNA P02545 3/20 0.37
KMT2A Q03164 3/20 0.37
ATM Q13315 1/20 0.37
KDM4E B2RXH2 2/20 0.36
COMT P21964 1/20 0.36
MEN1 O00255 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALOX5 P09917 1/20 0.36
CDC7 O00311 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
DBF4 Q9UBU7 1/20 0.35
CNR1 P21554 1/20 0.35

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
SCHEMBL578433 0.77
SCHEMBL12538503 0.77 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL18580661 0.75
SCHEMBL14543130 0.72 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1NPC1RAB9AHPGD
SCHEMBL22684748 0.70 MAPT (0.33) MAPT
SCHEMBL15225532 0.69 MGLL (0.47) SMN1; SMN2NPC1MAPTGAALMNA
SCHEMBL119711 0.68 TRPV6 (0.39) ALDH1A1
SCHEMBL584051 0.67 ALDH1A1 (0.33) SMN1; SMN2ALDH1A1HPGDLMNAKMT2A
SCHEMBL14830420 0.66 MGLL (0.51)
SCHEMBL1774449 0.66 LTA4H (0.40) SMN1; SMN2LMNAL3MBTL1

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-20150368278-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. (US) 2015-12-24 US disclosed
US-8957049-B2 Inhibitors of fatty acid amide hydrolase INFINITY PHARMACEUTICALS, INC. (US) 2015-02-17 US disclosed
US-20110172186-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. 2011-07-14 US disclosed
EP-2282742-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE Infinity Pharmaceuticals, Inc. (US) 2011-02-16 EP disclosed
WO-2009126691-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC (US) 2009-10-15 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-20110172186-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 SMN1; SMN2 3053/4885ALDH1A1 354/4885NPC1 472/4885
US-20150368278-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 SMN1; SMN2 3053/4885ALDH1A1 354/4885NPC1 472/4885

“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.