SCHEMBL15947206

SCHEMBL15947206

COc1ccc(/C(C)=N/Cc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
MAPT P10636 4/20 0.51
PKM P14618 1/20 0.51
CDK5 Q00535 1/20 0.51
CDK5R1 Q15078 1/20 0.51
TDP1 Q9NUW8 4/20 0.51
GAA P10253 2/20 0.51
HTT P42858 1/20 0.51
KMT2A Q03164 1/20 0.51
LTA4H P09960 1/20 0.50
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
NOS2 P35228 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
KDM4E B2RXH2 1/20 0.47
GRIN2B Q13224 2/20 0.47
THRB P10828 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ACHE P22303 1/20 0.47

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
SCHEMBL5799220 1.00 NPC1 (0.51) NPC1RAB9AMAPTPKMCDK5
SCHEMBL164345 0.84 GRIN2B (0.59) NPC1MAPTTDP1HTTNOS2
SCHEMBL987917 0.84 GRIN2B (0.59) NPC1MAPTTDP1HTTNOS2
SCHEMBL2206812 0.84 GRIN2B (0.59) NPC1MAPTTDP1HTTNOS2
SCHEMBL9133458 0.82 NPC1 (0.50) NPC1RAB9AMAPTTDP1LTA4H
SCHEMBL9133454 0.82 NPC1 (0.50) NPC1RAB9AMAPTTDP1LTA4H
Hydrochloric Acid SCHEMBL4741316 0.81 GRIN2B (0.67) NPC1RAB9AMAPTCDK5CDK5R1
SCHEMBL18829673 0.80 HTT (0.47) NPC1RAB9AMAPTGAAHTT
SCHEMBL27780177 0.79 NOS2 (0.50) MAPTHTTKMT2ANOS2L3MBTL1
SCHEMBL27780168 0.79 GRIN2B (0.65) NPC1RAB9AMAPTGAANOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015159170-A2 IMPROVED PROCESS FOR THE SYNTHESIS OF 1-(4-METHOXYPHENYL) ETHYLAMINE AND ITS ISOMERS SUVEN LIFE SCIENCES LIMITED (IN) 2015-10-22 WO disclosed
US-20140228579-A1 METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES Brock Unviersity (CA) 2014-08-14 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-20140228579-A1 METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES CA6, RUVBL2, HACL2 NPC1 2618/4885RAB9A 854/4885MAPT 4794/4885

“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.