SCHEMBL1725720

SCHEMBL1725720

O=C(CN1CCN(c2cccc(Cl)n2)C(=O)C1)N1CC=C(c2ccc(Cl)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.47
▸ NAMPT P43490 8/20 0.42
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ HTR1A P08908 2/20 0.39
▸ PARP1 P09874 1/20 0.39
▸ CCR1 P32246 1/20 0.38
▸ SIGMAR1 Q99720 3/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ USP2 O75604 1/20 0.38

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
SCHEMBL1726712 0.87 CNR1 (0.49) CNR1NAMPTHTR1ASIGMAR1MEN1
SCHEMBL1725351 0.80 TRPV1 (0.42) CNR1NAMPTMAPTNPSR1MEN1
SCHEMBL27932719 0.79 CNR1 (0.45) CNR1NAMPTLMNAMAPTHTT
SCHEMBL1578543 0.75 TRPV1 (0.41) MAPTNPSR1MEN1KMT2A
SCHEMBL1726251 0.75 MAPT (0.46) CNR1NAMPTLMNAMAPTMEN1
SCHEMBL1725911 0.73 NAMPT (0.41) NAMPT
SCHEMBL1578403 0.73 ALDH1A1 (0.43) NAMPTLMNAMAPTHTTNPSR1
SCHEMBL1578462 0.72 MEN1 (0.43) NAMPTLMNAMAPTHTTMEN1
SCHEMBL1578464 0.71 MMP2 (0.40) NAMPTMAPTMEN1KMT2AUSP2
SCHEMBL1578587 0.71 GRIN2B (0.39) NAMPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120289518-A1 DERIVATIVES OF 2-OXOALKYL-1-PIPERAZIN-2-ONE, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI (FR) 2012-11-15 — — US claimed
US-8247404-B2 Derivatives of 2-oxoalkyl-1-piperazin-2-one, preparation method thereof and therapeutic use of same SANOFI (FR) 2012-08-21 — — US claimed
WO-2011144835-A3 TUBULAR PHOTOVOLTAIC DEVICE FOR PRODUCING ELECTRICAL ENERGY THEROND PATRICK (FR) 2012-05-10 — — WO claimed
EP-2310383-B1 DERIVATIVES OF 2-OXO-ALKYL-1-PIPERAZIN-2-ONE, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI SA (FR) 2011-11-30 — — EP claimed
US-20110144122-A1 DERIVATIVES OF 2-OXOALKYL-1-PIPERAZIN-2-ONE, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI-AVENTIS (FR) 2011-06-16 — — US claimed
US-20170189522-A1 PHARMACEUTICAL COMBINATIONS FOR IMMUNOTHERAPY TECHNISCHE UNIVERSITAT DRESDEN (DE) 2017-07-06 — — US disclosed
WO-2015181298-A1 PHARMACEUTICAL COMBINATIONS FOR IMMUNOTHERAPY Technische Universität Dresden (DE) 2015-12-03 — — WO disclosed
US-20120289518-A1 DERIVATIVES OF 2-OXOALKYL-1-PIPERAZIN-2-ONE, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI (FR) 2012-11-15 — — US disclosed
US-8247404-B2 Derivatives of 2-oxoalkyl-1-piperazin-2-one, preparation method thereof and therapeutic use of same SANOFI (FR) 2012-08-21 — — US disclosed
WO-2011144835-A3 TUBULAR PHOTOVOLTAIC DEVICE FOR PRODUCING ELECTRICAL ENERGY THEROND PATRICK (FR) 2012-05-10 — — WO disclosed
EP-2310383-B1 DERIVATIVES OF 2-OXO-ALKYL-1-PIPERAZIN-2-ONE, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI SA (FR) 2011-11-30 — — EP disclosed
US-20110144122-A1 DERIVATIVES OF 2-OXOALKYL-1-PIPERAZIN-2-ONE, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI-AVENTIS (FR) 2011-06-16 — — 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 (3 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-20110144122-A1 DERIVATIVES OF 2-OXOALKYL-1-PIPERAZIN-2-ONE, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME PKD2, OPRM1, DHFR CNR1 47/4885NAMPT 1922/4885LMNA 2003/4885
US-20120289518-A1 DERIVATIVES OF 2-OXOALKYL-1-PIPERAZIN-2-ONE, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME PKD2, OPRM1, DHFR CNR1 47/4885NAMPT 1922/4885LMNA 2003/4885
US-20170189522-A1 PHARMACEUTICAL COMBINATIONS FOR IMMUNOTHERAPY TLR9, TLR7, TLR3 CNR1 176/4885NAMPT 826/4885LMNA 2984/4885

“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.

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