SCHEMBL1726712

SCHEMBL1726712

O=C(CN1CCN(c2ccccn2)C(=O)C1)N1CC=C(c2ccc(Cl)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.49
▸ NAMPT P43490 11/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HTR1A P08908 1/20 0.41
▸ SIGMAR1 Q99720 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ DPP4 P27487 1/20 0.39

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
SCHEMBL1725720 0.87 CNR1 (0.47) CNR1NAMPTHTR1ASIGMAR1MEN1
SCHEMBL1726251 0.87 MAPT (0.46) CNR1NAMPTALDH1A1SMN1; SMN2MEN1
SCHEMBL1578403 0.84 ALDH1A1 (0.43) NAMPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL1725351 0.83 TRPV1 (0.42) CNR1NAMPTALDH1A1SMN1; SMN2MEN1
SCHEMBL1578464 0.82 MMP2 (0.40) NAMPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL27948508 0.79 CNR1 (0.47) CNR1NAMPTALDH1A1SMN1; SMN2HTR1A
SCHEMBL1578462 0.78 MEN1 (0.43) NAMPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL1725911 0.77 NAMPT (0.41) NAMPTSMN1; SMN2
SCHEMBL1578543 0.77 TRPV1 (0.41) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL4813430 0.75 NAMPT (0.49) CNR1NAMPTSMN1; SMN2SIGMAR1DPP4

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 1922/4885ALDH1A1 37/4885
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 1922/4885ALDH1A1 37/4885
US-20170189522-A1 PHARMACEUTICAL COMBINATIONS FOR IMMUNOTHERAPY TLR9, TLR7, TLR3 CNR1 176/4885NAMPT 826/4885ALDH1A1 4437/4885

“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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