SCHEMBL4166207

SCHEMBL4166207

Cc1ccc(Oc2ccnc(Nc3cccc(C(=O)NC4CCN(C)CC4)c3)c2)c(C)n1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 6/20 0.51
CDK2 P24941 8/20 0.49
CCNE1 P24864 5/20 0.49
CCNT1 O60563 3/20 0.49
CCNA2 P20248 3/20 0.49
CDK9 P50750 3/20 0.49
ROCK2 O75116 1/20 0.49
GSK3A P49840 3/20 0.48
CDK1 P06493 2/20 0.47
CCNB1 P14635 2/20 0.47
CDK7 P50613 2/20 0.47
CCNH P51946 2/20 0.47
NTRK1 P04629 1/20 0.44
NTRK3 Q16288 1/20 0.44
NTRK2 Q16620 1/20 0.44
SRC P12931 1/20 0.44
SYK P43405 1/20 0.44
MAPK14 Q16539 1/20 0.44
ATR Q13535 1/20 0.43

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
SCHEMBL4171178 0.94 TGFBR1 (0.55) TGFBR1CDK2CCNE1
SCHEMBL4180018 0.91 TGFBR1 (0.56) TGFBR1CDK2CCNE1GSK3ACDK1
SCHEMBL3944569 0.85 TGFBR1 (0.54) TGFBR1CDK2CCNE1CCNT1CCNA2
SCHEMBL4170278 0.85 TGFBR1 (0.50) TGFBR1
SCHEMBL4038595 0.84 TGFBR1 (0.49) TGFBR1SYK
SCHEMBL3944990 0.84 TGFBR1 (0.62) TGFBR1
SCHEMBL3947619 0.83 TGFBR1 (0.61) TGFBR1
SCHEMBL3952724 0.82 TGFBR1 (0.55) TGFBR1
SCHEMBL3949465 0.81 TGFBR1 (0.61) TGFBR1SRC
SCHEMBL3947614 0.80 TGFBR1 (0.60) TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048269-A1 CHEMICAL COMPOUNDS-821 ASTRAZENECA AB (SE) 2009-02-19 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-20090048269-A1 CHEMICAL COMPOUNDS-821 TGFBR1, TGFBR2, SMAD3 TGFBR1 1/4885CDK2 2833/4885CCNE1 2325/4885

“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.