SCHEMBL3704077

SCHEMBL3704077

Cc1csc(-c2nnc(Nc3ccc(Sc4ccnc5cc[nH]c45)cc3)c3ccccc23)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.48
ULK1 O75385 1/20 0.48
RPS6KA5 O75582 1/20 0.48
RPS6KA4 O75676 1/20 0.48
PRKD3 O94806 1/20 0.48
ABL1 P00519 1/20 0.48
FES P07332 1/20 0.48
RET P07949 1/20 0.48
BCR P11274 1/20 0.48
BRAF P15056 1/20 0.48
NQO2 P16083 1/20 0.48
MAP2K2 P36507 1/20 0.48
MAPKAPK2 P49137 1/20 0.48
CLK1 P49759 1/20 0.48
CLK2 P49760 1/20 0.48
CLK3 P49761 1/20 0.48
MAP2K1 Q02750 1/20 0.48
TOP2B Q02880 1/20 0.48
PRKCD Q05655 1/20 0.48
DDR1 Q08345 1/20 0.48

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
SCHEMBL3693760 0.87 AURKA (0.46) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL15663360 0.85 AURKA (0.49) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL15663399 0.84 AURKA (0.53) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL3696177 0.84 AURKA (0.49) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL3710855 0.84 ENPP3 (0.45) AURKABRAFAURKBKDRENPP3
SCHEMBL3708600 0.83 AURKA (0.48) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL3694560 0.82 AURKA (0.49) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL3703813 0.80 KDR (0.48) BRAFKDRENPP3MAPTPOLB
SCHEMBL3703013 0.80 AURKA (0.45) AURKAULK1RPS6KA5RPS6KA4PRKD3
SCHEMBL2209367 0.80 AURKA (0.49) AURKAULK1RPS6KA5RPS6KA4PRKD3

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-8557816-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2013-10-15 US claimed
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2012-05-17 US claimed
EP-2137177-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-05-07 EP 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-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, CDK1 AURKA 2/4885ULK1 444/4885RPS6KA5 192/4885

“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.