SCHEMBL20575557

SCHEMBL20575557

Cc1c(F)ccc(N2C=C3CCCN3C2c2ccc3[nH]ncc3c2)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCNC P24863 1/20 0.39
CDK8 P49336 1/20 0.39
DDR1 Q08345 10/20 0.37
FASN P49327 1/20 0.36
NOS1 P29475 1/20 0.34
ROCK2 O75116 4/20 0.34
ROCK1 Q13464 2/20 0.34
DRD4 P21917 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
CCR2 P41597 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MET P08581 1/20 0.33

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
SCHEMBL20575632 0.92 FASN (0.35) CCNCCDK8FASNROCK2ROCK1
SCHEMBL20575525 0.91 FASN (0.35) CCNCCDK8DDR1FASNROCK2
SCHEMBL20575973 0.86 DRD4 (0.36) CCNCCDK8DDR1FASNNOS1
SCHEMBL20574806 0.86 CCNC (0.38) CCNCCDK8FASNNOS1ROCK2
SCHEMBL20575514 0.86 FASN (0.37) CCNCCDK8FASNROCK2ROCK1
SCHEMBL20576473 0.84 FASN (0.37) CCNCCDK8FASNROCK2ROCK1
SCHEMBL20576413 0.84 FASN (0.37) CCNCCDK8FASNROCK2ROCK1
SCHEMBL20575608 0.84 FASN (0.37) CCNCCDK8FASNROCK2ROCK1
SCHEMBL20575165 0.83 FASN (0.37) CCNCCDK8FASNROCK2ROCK1
SCHEMBL20575517 0.83 CYP2D6 (0.38) CCNCCDK8FASNROCK2ROCK1

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
US-10696693-B2 Fused imidazole derivatives as TGF-beta inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2020-06-30 US disclosed
US-20180346487-A1 Fused Imidazole Derivatives as TGF-Beta Inhibitors MIDCAP FINANCIAL TRUST 2018-12-06 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 (2 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-10696693-B2 Fused imidazole derivatives as TGF-beta inhibitors TGFBR1, TGFBR2, SMAD3 CCNC 2802/4885CDK8 754/4885DDR1 1086/4885
US-20180346487-A1 Fused Imidazole Derivatives as TGF-Beta Inhibitors TGFBR1, TGFBR2, SMAD3 CCNC 2802/4885CDK8 754/4885DDR1 1086/4885

“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.