SCHEMBL15536995

SCHEMBL15536995

CCOC(=O)N(S)C(=O)Nc1cc(Cl)ccn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.48
NOS2 P35228 1/20 0.48
FGFR4 P22455 1/20 0.45
GSK3A P49840 1/20 0.41
MAPK10 P53779 1/20 0.41
RIOK2 Q9BVS4 1/20 0.41
MAPT P10636 4/20 0.40
ALDH1A1 P00352 4/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PKM P14618 1/20 0.40
KMT2A Q03164 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 1/20 0.39
GRM5 P41594 1/20 0.38
IDE P14735 1/20 0.38
EGFR P00533 1/20 0.38
HPGD P15428 1/20 0.37

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
SCHEMBL9105468 0.85 RIOK2 (0.41) RIOK2ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL16926553 0.80 NOS1 (0.55) NOS1NOS2GSK3AMAPK10RIOK2
SCHEMBL22408359 0.75 FGFR4 (0.57) FGFR4GSK3AMAPK10RIOK2MAPT
SCHEMBL15536991 0.73 MAPT (0.51) NOS1NOS2MAPTALDH1A1NPC1
SCHEMBL14812038 0.73 RAB9A (0.51) MAPTNPC1RAB9AKMT2AGAA
SCHEMBL2762187 0.71 MAPT (0.55) NOS1NOS2FGFR4GSK3AMAPK10
SCHEMBL16926556 0.70 JAK2 (0.58) NOS1NOS2FGFR4GSK3AMAPK10
SCHEMBL1122640 0.70 JAK2 (0.56) FGFR4GSK3AMAPK10RIOK2MAPT
SCHEMBL29728783 0.70 JAK2 (0.56) FGFR4GSK3AMAPK10RIOK2MAPT
SCHEMBL31420515 0.70 JAK2 (0.61) GSK3AMAPK10RIOK2

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
EP-2855455-B1 TRIAZOLO COMPOUNDS AS PDE10 INHIBITORS HOFFMANN LA ROCHE (CH) 2017-11-08 EP disclosed
US-9394311-B2 Triazolo compounds as PDE10 inhibitors HOFFMANN-LA ROCHE INC. (US) 2016-07-19 US disclosed
US-20150148332-A1 TRIAZOLO COMPOUNDS AS PDE10 INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2015-05-28 US disclosed
EP-2855455-A1 TRIAZOLO COMPOUNDS AS PDE10 INHIBITORS F. Hoffmann-La Roche AG (CH) 2015-04-08 EP disclosed
WO-2013178572-A1 TRIAZOLO COMPOUNDS AS PDE10 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-12-05 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 (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-20150148332-A1 TRIAZOLO COMPOUNDS AS PDE10 INHIBITORS PDE3A, PDE3B, PDE5A NOS1 121/4885NOS2 132/4885FGFR4 2760/4885

“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.