SCHEMBL1936552

SCHEMBL1936552

O=C1CCCN1c1cccc(Nc2ncc(Cl)c(NC3CC3)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.55
MAPK8 P45983 1/20 0.53
MAPK9 P45984 1/20 0.53
MAPK10 P53779 1/20 0.53
ALK Q9UM73 6/20 0.50
MET P08581 1/20 0.50
ROS1 P08922 1/20 0.50
INSR P06213 4/20 0.49
CAMK1D Q8IU85 2/20 0.47
BRD4 O60885 2/20 0.46
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
CTSC P53634 1/20 0.46
GAA P10253 1/20 0.44

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
SCHEMBL1937571 0.89 ALK (0.47) SYKMAPK8MAPK9MAPK10ALK
SCHEMBL1936571 0.86 ULK1 (0.58) SYK
SCHEMBL764400 0.85 SYK (0.72) SYKCAMK1D
SCHEMBL2510547 0.82 CAMK1D (0.47) SYKALKINSRCAMK1DBRD4
SCHEMBL1937351 0.80 SYK (0.47) SYKMAPK8MAPK9MAPK10ALK
SCHEMBL2505875 0.78 SYK (0.41) SYKMAPK8MAPK9MAPK10ALK
SCHEMBL1937612 0.78 ALK (0.45) SYKALKINSRBRD4CTSC
SCHEMBL1936513 0.77 FFAR1 (0.47) SYKMAPK8MAPK9MAPK10CAMK1D
SCHEMBL13363313 0.76 FFAR1 (0.51) SYKMAPK8MAPK9MAPK10FFAR1
SCHEMBL2511992 0.76 CTSC (0.52) SYKALKINSRBRD4CTSC

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-20110245242-A1 Heterocyclically Substituted Anilinopyrimides BAYER CROPSCIENCE AG (DE) 2011-10-06 US disclosed
EP-2331524-A1 HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES Bayer CropScience AG (DE) 2011-06-15 EP disclosed
WO-2010025831-A1 HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-03-11 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-20110245242-A1 Heterocyclically Substituted Anilinopyrimides H1-10, POLL, PPM1D SYK 1494/4885MAPK8 2444/4885MAPK9 2301/4885

“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.