SCHEMBL5548847

SCHEMBL5548847

C#CCN1CCN(C(=O)NC)CC1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.59
BCHE P06276 5/20 0.41
KMT2A Q03164 1/20 0.39
MAOB P27338 8/20 0.37
KDM4E B2RXH2 1/20 0.33
KDR P35968 1/20 0.33
MAOA P21397 1/20 0.33

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
SCHEMBL313821 0.82 POLB (0.55) POLBKMT2AKDM4EKDR
SCHEMBL312907 0.80 POLB (0.52) POLBKMT2AKDR
SCHEMBL928074 0.79 CYP2D6 (0.42) BCHEKMT2AMAOB
SCHEMBL299361 0.79 PIK3CD (0.52) BCHEKMT2AKDM4E
SCHEMBL13176215 0.77 POLB (1.00) POLBKMT2AKDM4E
SCHEMBL8418345 0.76 POLB (0.70) POLBKMT2AKDM4E
SCHEMBL16116415 0.76 BCHE (0.41) BCHEMAOBMAOA
SCHEMBL138635 0.76 BCHE (0.41) BCHEMAOBMAOA
SCHEMBL27482144 0.76 BLM (0.42) POLBBCHEKMT2A
SCHEMBL20328131 0.75 POLB (0.67) POLBKMT2AKDM4EKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1147093-B1 SUBSTITUTED BICYCLIC DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PROD INC (US) 2007-04-11 EP disclosed
US-20030186995-A1 Substituted bicyclic derivatives useful as anticancer agents PFIZER INC. 2003-10-02 US disclosed
US-6541481-B2 A quinazoline compound PFIZER INC 2003-04-01 US disclosed
US-20010034351-A1 Substituted bicyclic derivatives useful as anticancer agents KATH JOHN CHARLES (US) 2001-10-25 US disclosed
US-6284764-B1 ANTIPROLIFERATIVE AGENT PFIZER INC. 2001-09-04 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-20030186995-A1 Substituted bicyclic derivatives useful as anticancer agents CCNA1, MCL1, RCC1 POLB 2389/4885BCHE 3484/4885KMT2A 2888/4885
US-20010034351-A1 Substituted bicyclic derivatives useful as anticancer agents CCNA1, MCL1, RCC1 POLB 2389/4885BCHE 3484/4885KMT2A 2888/4885

“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.