SCHEMBL15939748

SCHEMBL15939748

Cl/C(=N\Cc1ccccc1)c1ccco1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 6/20 0.43
GRIN1 Q05586 4/20 0.43
NOS2 P35228 1/20 0.43
PTPN1 P18031 1/20 0.41
GAA P10253 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
RAB9A P51151 3/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
GRIN2D O15399 2/20 0.40
GRIN3B O60391 2/20 0.40
GRIN2A Q12879 2/20 0.40
GRIN2C Q14957 2/20 0.40
GRIN3A Q8TCU5 2/20 0.40
SIGMAR1 Q99720 2/20 0.40

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
SCHEMBL15939749 1.00 GRIN2B (0.43) GRIN2BGRIN1NOS2PTPN1GAA
SCHEMBL7830039 0.76 GRIN2B (0.59) GRIN2BGRIN1NOS2NPC1GRIN2D
SCHEMBL7466196 0.76 GRIN2B (0.59) GRIN2BGRIN1NOS2NPC1GRIN2D
SCHEMBL11767183 0.74
SCHEMBL6608297 0.70 CES2 (0.50) PTPN1CES2CES1RAB9AALDH1A1
SCHEMBL45769 0.69 GRIN2B (0.68) GRIN2BGRIN1NOS2RAB9ASMN1; SMN2
SCHEMBL5644274 0.68
SCHEMBL15939543 0.68 SMN1; SMN2 (0.43) GRIN2BGRIN1NOS2RAB9AALDH1A1
SCHEMBL15939542 0.68 SMN1; SMN2 (0.43) GRIN2BGRIN1NOS2RAB9AALDH1A1
SCHEMBL23340458 0.67 CES2 (0.62) PTPN1CES2CES1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140228579-A1 METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES Brock Unviersity (CA) 2014-08-14 US disclosed
US-20140228579-A1 METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES Brock Unviersity (CA) 2014-08-14 US 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 GRIN2B 1330/4885GRIN1 1346/4885NOS2 1337/4885

“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.