SCHEMBL2458809

SCHEMBL2458809

CC(C)NC(=O)CNC(=O)c1cc(N2CCNC(C(C)C)C2)ccc1N

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP25 Q9UHP3 2/20 0.43
USP28 Q96RU2 1/20 0.43
HDAC1 Q13547 1/20 0.41
PRKCQ Q04759 2/20 0.38
CCR2 P41597 12/20 0.37
IP6K1 Q92551 1/20 0.37
P2RX7 Q99572 1/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CDK2 P24941 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
SCHEMBL3451783 1.00 USP25 (0.43) USP25USP28HDAC1PRKCQCCR2
SCHEMBL2458801 1.00 USP25 (0.43) USP25USP28HDAC1PRKCQCCR2
SCHEMBL2460684 0.95 USP25 (0.39) USP25USP28HDAC1PRKCQCCR2
SCHEMBL2462788 0.95 USP25 (0.39) USP25USP28HDAC1PRKCQCCR2
SCHEMBL2459768 0.90 MAPT (0.41) USP25USP28HDAC1CCR2IP6K1
SCHEMBL2463515 0.90 MAPT (0.41) USP25USP28HDAC1CCR2IP6K1
SCHEMBL2459776 0.90 MAPT (0.41) USP25USP28HDAC1CCR2IP6K1
SCHEMBL2461995 0.87 ADRB1 (0.38) USP25USP28CCR2IP6K1P2RX7
SCHEMBL2459779 0.86 IP6K1 (0.40) CCR2IP6K1P2RX7
SCHEMBL2458975 0.83 IP6K1 (0.38) 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 USP25 3089/4885USP28 2997/4885HDAC1 179/4885

“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.