SCHEMBL2349161

SCHEMBL2349161

O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1cc2c3c(ccn3CCC2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 11/20 0.51
PRKCH P24723 11/20 0.51
PRKCE Q02156 11/20 0.51
PRKCD Q05655 11/20 0.51
PRKCQ Q04759 10/20 0.51
PRKCB P05771 10/20 0.51
CDK2 P24941 4/20 0.51
CAMK2D Q13557 4/20 0.51
ABL1 P00519 3/20 0.51
CDK4 P11802 3/20 0.51
CCND1 P24385 3/20 0.51
PRKD3 O94806 3/20 0.51
PRKCG P05129 3/20 0.51
PIM1 P11309 3/20 0.51
PRKCZ Q05513 3/20 0.51
PRKACA P17612 3/20 0.51
CDK1 P06493 2/20 0.51
PRKCI P41743 2/20 0.51
CCNE2 O96020 2/20 0.51
PRKACG P22612 2/20 0.51

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
SCHEMBL2349685 0.88 KDR (0.51) PRKCAPRKCHPRKCEPRKCDPRKCQ
SCHEMBL2340281 0.82 GSK3B (0.43) PRKCAPRKCQPRKCBGSK3BGSK3A
SCHEMBL2341048 0.80 PRKCB (0.59) PRKCAPRKCHPRKCEPRKCDPRKCQ
SCHEMBL6324887 0.77 PRKCB (0.51) PRKCAPRKCHPRKCEPRKCDPRKCQ
SCHEMBL6325786 0.77 CDK4 (0.52) PRKCAPRKCHPRKCEPRKCDPRKCQ
SCHEMBL6335215 0.77 GSK3B (0.52) PRKCAPRKCHPRKCEPRKCDPRKCQ
SCHEMBL224940 0.76 CDK4 (0.61) PRKCAPRKCHPRKCEPRKCDPRKCQ
SCHEMBL6328464 0.74 PRKD1 (0.52) PRKCAPRKCHPRKCEPRKCDPRKCQ
SCHEMBL2344815 0.74 GSK3B (0.44) PRKCAGSK3BSLK
SCHEMBL6329959 0.73 CDK4 (0.60) PRKCAPRKCHPRKCEPRKCDPRKCQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8513292-B2 Compositions and methods for the treatment of cancer ARQULE, INC. (US) 2013-08-20 US disclosed
US-8513292-B2 Compositions and methods for the treatment of cancer ARQULE, INC. (US) 2013-08-20 US disclosed
US-8513292-B2 Compositions and methods for the treatment of cancer ARQULE, INC. (US) 2013-08-20 US disclosed
EP-2392574-A1 Indolyl pyrrolidines for the treatment of cancer ArQule, Inc. (US) 2011-12-07 EP disclosed
EP-2173748-B1 INDOLYL PYRROLIDINES FOR THE TREATMENT OF CANCER ARQULE INC (US) 2011-08-31 EP disclosed
US-20100183603-A1 Compositions and Methods for the Treatment of Cancer ARQULE, INC. (US) 2010-07-22 US disclosed
US-20100183603-A1 Compositions and Methods for the Treatment of Cancer ARQULE, INC. (US) 2010-07-22 US disclosed
US-20100183603-A1 Compositions and Methods for the Treatment of Cancer ARQULE, INC. (US) 2010-07-22 US disclosed
EP-2173748-A2 INDOLYL PYRROLIDINES FOR THE TREATMENT OF CANCER ArQule, Inc. (US) 2010-04-14 EP disclosed
WO-2009002807-A2 INDOLYL PYRROLIDINES FOR THE TREATMENT OF CANCER ARQULE, INC. (US) 2008-12-31 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-20100183603-A1 Compositions and Methods for the Treatment of Cancer MKI67, POLI, DHPS PRKCA 881/4885PRKCH 584/4885PRKCE 1506/4885

“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.