SCHEMBL6976420

SCHEMBL6976420

CC(C)=NOCCNC1CCN(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.40
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MITF O75030 1/20 0.35
ADRB2 P07550 2/20 0.32
ADRB1 P08588 2/20 0.32
ADRB3 P13945 2/20 0.32
OPRL1 P41146 4/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL6978880 0.86 KDM4E (0.34) CYP2D6
SCHEMBL6979252 0.83 EPHX2 (0.42) OPRL1
SCHEMBL6980139 0.81 KDM4E (0.41) DPP7CYP2D6
SCHEMBL6976860 0.81 TP53 (0.41) OPRL1
SCHEMBL6976911 0.79 OPRL1 (0.33) OPRL1CYP2D6
SCHEMBL6958352 0.78 MEN1 (0.35) DPP7MEN1KMT2AMITFADRB2
SCHEMBL24204664 0.76 MEN1 (0.47) DPP7MEN1KMT2AMITFADRB2
SCHEMBL190633 0.75 EHMT2 (0.40) DPP7MEN1KMT2AMITFOPRL1
SCHEMBL22479349 0.73 MEN1 (0.38) DPP7MEN1KMT2AMITFOPRL1
SCHEMBL14980405 0.72 DPP7 (0.38) DPP7MEN1KMT2AMITFADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8349857-B2 Quinazoline derivatives having tyrosine kinase inhibitory activity SHIONOGI & CO., LTD. (JP) 2013-01-08 US disclosed
US-8202879-B2 Quinazoline derivatives having tyrosine kinase inhibitory activity SHIONOGI & CO., LTD. (JP) 2012-06-19 US disclosed
US-20120123114-A1 QUINAZOLINE DERIVATIVES HAVING TYROSINE KINASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-05-17 US disclosed
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity SHIONOGI & CO., LTD. (JP) 2009-06-04 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-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity ERBB2, EGFR, ABL1 DPP7 2122/4885MEN1 3302/4885KMT2A 1949/4885
US-20120123114-A1 QUINAZOLINE DERIVATIVES HAVING TYROSINE KINASE INHIBITORY ACTIVITY ERBB2, EGFR, ABL1 DPP7 2122/4885MEN1 3302/4885KMT2A 1949/4885

“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.