SCHEMBL2463471

SCHEMBL2463471

CC(C)NC(=O)CNC(=O)c1cc(N2CCCC(CN(C)C)C2)ccc1N

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.41
CTSC P53634 1/20 0.41
CCR2 P41597 12/20 0.38
IP6K1 Q92551 1/20 0.38
FAP Q12884 1/20 0.36
TRPA1 O75762 3/20 0.35
AVPR2 P30518 2/20 0.35
AVPR1A P37288 1/20 0.35

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
SCHEMBL2462414 0.86 CCR2 (0.40) CCR2IP6K1AVPR2AVPR1A
SCHEMBL2462420 0.86 CCR2 (0.40) CCR2IP6K1AVPR2AVPR1A
SCHEMBL2462424 0.86 CCR2 (0.40) CCR2IP6K1AVPR2AVPR1A
SCHEMBL2461019 0.84 PRKDC (0.43) CCR2IP6K1
SCHEMBL2459038 0.84 AVPR1B (0.43) CCR2
SCHEMBL2463468 0.84 CTSK (0.41) CTSKCTSCIP6K1TRPA1AVPR2
SCHEMBL2461135 0.82 AVPR1B (0.42) CCR2IP6K1
SCHEMBL2462381 0.82 CCR2 (0.41) CCR2IP6K1
SCHEMBL2490194 0.81 HDAC4 (0.42) CTSKCTSCCCR2IP6K1FAP
SCHEMBL2462443 0.81 CCR2 (0.39) CCR2IP6K1

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 CTSK 1380/4885CTSC 1399/4885CCR2 3951/4885

“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.