SCHEMBL2463353

SCHEMBL2463353

CCCC1CN(c2ccc(N)c(C(=O)NCC(=O)NC(C)C)c2)CCCN1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IP6K1 Q92551 1/20 0.36
CCR2 P41597 18/20 0.35
ADRB1 P08588 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
SCHEMBL2458975 0.93 IP6K1 (0.38) IP6K1CCR2ADRB1
SCHEMBL2462015 0.91 ADRB1 (0.35) IP6K1CCR2ADRB1
SCHEMBL2460684 0.86 USP25 (0.39) IP6K1CCR2
SCHEMBL2462788 0.86 USP25 (0.39) IP6K1CCR2
SCHEMBL2461995 0.86 ADRB1 (0.38) IP6K1CCR2ADRB1
SCHEMBL2463515 0.83 MAPT (0.41) IP6K1CCR2
SCHEMBL2459768 0.83 MAPT (0.41) IP6K1CCR2
SCHEMBL2459776 0.83 MAPT (0.41) IP6K1CCR2
SCHEMBL2458809 0.82 USP25 (0.43) IP6K1CCR2
SCHEMBL2458801 0.82 USP25 (0.43) IP6K1CCR2

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
EP-2069315-B1 QUINAZOLINONE AND ISOQUINOLINONE ACETAMIDE DERIVATIVES ORGANON NV (NL) 2011-09-07 EP disclosed
US-7820649-B2 Quinazolinone and isoquinolinone acetamide derivatives N.V. ORGANON (NL) 2010-10-26 US disclosed
US-20080090802-A1 QUINAZOLINONE AND ISOQUINOLINONE ACETAMIDE DERIVATIVES N.V. ORGANON (NL) 2008-04-17 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 (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-20080090802-A1 QUINAZOLINONE AND ISOQUINOLINONE ACETAMIDE DERIVATIVES NQO2, GATD3, SDHA IP6K1 2048/4885CCR2 3951/4885ADRB1 584/4885

“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.