SCHEMBL6319465

SCHEMBL6319465

NC(=O)c1cccc(N/C(=C2\C(=O)Nc3ccccc32)c2ccccc2)c1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 12/20 0.45
PARP10 Q53GL7 11/20 0.45
PARP15 Q460N3 6/20 0.45
PARP14 Q460N5 4/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
AKT2 P31751 1/20 0.42
PDPK1 O15530 1/20 0.41
KDR P35968 2/20 0.40
IDO1 P14902 1/20 0.39

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
SCHEMBL6321984 1.00 PARP1 (0.45) PARP1PARP10PARP15PARP14MEN1
SCHEMBL6319477 0.90 GSK3B (0.47) MEN1KMT2A
SCHEMBL6319473 0.90 GSK3B (0.47) MEN1KMT2A
SCHEMBL6326901 0.89 PLAU (0.40) AKT2PDPK1KDRIDO1
SCHEMBL6318906 0.88 PDPK1 (0.39) MEN1KMT2AAKT2PDPK1KDR
SCHEMBL6322523 0.88 KDR (0.44) PARP1KMT2AKDRIDO1
SCHEMBL6322520 0.88 KDR (0.44) PARP1KMT2AKDRIDO1
SCHEMBL3157766 0.88 PLAU (0.46) PARP1PARP10PARP15PARP14MEN1
SCHEMBL3157774 0.88 PLAU (0.46) PARP1PARP10PARP15PARP14MEN1
SCHEMBL6320960 0.87 PDPK1 (0.46) MEN1KMT2APDPK1KDRIDO1

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-6855710-B2 Substituted indolines with an inhibitory effect on various kinases and complexes of CDKs BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-02-15 US disclosed
US-20040058978-A1 Novel substituted indolines with an inhibitory effect on various kinases and complexes of CDKs BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-25 US disclosed
EP-1115704-B1 NOVEL SUBSTITUTED INDOLINONES WITH AN INHIBITORY EFFECT ON VARIOUS KINASES AND CYCLIN/CDK COMPLEXES BOEHRINGER INGELHEIM PHARMA (DE) 2003-06-18 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-20040058978-A1 Novel substituted indolines with an inhibitory effect on various kinases and complexes of CDKs CDK1, CDK2, CDK3 PARP1 1117/4885PARP10 1656/4885PARP15 1448/4885

“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.