SCHEMBL17428656

SCHEMBL17428656

Cc1ccc(Cl)cc1-c1ccc2onc(N)c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.60
MAPK14 Q16539 5/20 0.45
SCN9A Q15858 6/20 0.44
CYP2C9 P11712 2/20 0.44
CYP3A4 P08684 2/20 0.42
SCN1A P35498 1/20 0.42
SCN5A Q14524 1/20 0.42
SCN2A Q99250 1/20 0.42
SCN8A Q9UQD0 1/20 0.42
LCK P06239 2/20 0.41
CSF1R P07333 2/20 0.41
KDR P35968 3/20 0.39
FLT3 P36888 3/20 0.39
KIT P10721 2/20 0.39
ABL1 P00519 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CHEK1 O14757 1/20 0.38
NTRK1 P04629 1/20 0.38
FYN P06241 1/20 0.38

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
SCHEMBL14919892 0.84 SCN9A (0.45) MAP4K4SCN9ACYP2C9CYP3A4SCN1A
SCHEMBL19075514 0.83 SCN9A (0.44) MAP4K4SCN9ACYP2C9CYP3A4SCN1A
SCHEMBL30828709 0.80 IDO1 (0.50) SCN9ACYP2C9KMT2A
SCHEMBL481909 0.80 IDO1 (0.50) SCN9ACYP2C9KMT2A
SCHEMBL15587286 0.75 MAP4K4 (1.00) MAP4K4
SCHEMBL16021504 0.73 MEN1 (0.45) MAP4K4MAPK14MEN1KMT2APIM1
SCHEMBL20414481 0.71 AHR (0.54) MAP4K4MEN1KMT2A
SCHEMBL15638204 0.71 MAP4K4 (0.44) MAP4K4SCN9ACYP2C9LCKCSF1R
SCHEMBL482377 0.70 IDO1 (0.47) KMT2AAURKB
SCHEMBL29652381 0.70 MAPT (0.50) MAP4K4CYP3A4LCKCSF1RKDR

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
EP-3166939-B1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH INC (US) 2019-06-05 EP disclosed
US-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-07-06 US disclosed
WO-2016007534-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2016-01-14 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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 MAP4K4 4072/4885MAPK14 4832/4885SCN9A 2337/4885

“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.