SCHEMBL183129

SCHEMBL183129

CCOC(=O)COc1ccc(OCCCCN2CCN(c3ccccc3OC)CC2)cc1[N+](=O)[O-]

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.57
SLC6A4 P31645 2/20 0.57
DRD2 P14416 10/20 0.56
DRD3 P35462 8/20 0.56
ADRA1A P35348 1/20 0.56
DRD4 P21917 6/20 0.56
DRD1 P21728 1/20 0.56
HTR2A P28223 1/20 0.56
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ALDH1A1 P00352 2/20 0.53
LMNA P02545 2/20 0.53
KDM4E B2RXH2 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 1/20 0.53
NLRP1 Q9C000 1/20 0.53
KCNH2 Q12809 1/20 0.52

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
SCHEMBL8165643 0.92 DRD2 (0.49) SLC6A2SLC6A4DRD2DRD3ADRA1A
SCHEMBL4250365 0.89 DRD2 (0.45) SLC6A2SLC6A4DRD2DRD3ADRA1A
SCHEMBL8041607 0.88 KDM4E (0.50) DRD2DRD3ADRA1AHTR2AMEN1
SCHEMBL182966 0.88 DRD2 (0.57) DRD2DRD3DRD4DRD1HTR2A
SCHEMBL1491165 0.87 KDM4E (0.43) SLC6A2SLC6A4DRD2DRD3ADRA1A
SCHEMBL3407475 0.82 SLC6A2 (0.61) SLC6A2SLC6A4DRD2DRD3ADRA1A
SCHEMBL182524 0.76 PLA2G4B (0.54) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL11080260 0.76 HTR1A (0.67) DRD2DRD3DRD4HTR2AALDH1A1
SCHEMBL182622 0.75 RAB9A (0.56) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL3157625 0.75 DRD2 (0.81) DRD2DRD3DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9975862-B2 Arylpiperazine derivatives and methods of utilizing same REVIVA PHARMACEUTICALS, INC. (US) 2018-05-22 US disclosed
US-20170327477-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME REVIVA PHARMACEUTICALS INC (US) 2017-11-16 US disclosed
US-9604944-B2 Arylpiperazine derivatives and methods of utilizing same REVIVA PHARMACEUTICALS, INC. (US) 2017-03-28 US disclosed
EP-2400968-B1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES REVIVA PHARMACEUTICALS INC (US) 2016-09-28 EP disclosed
US-20160229821-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME REVIVA PHARMACEUTICALS INC (US) 2016-08-11 US disclosed
US-9255076-B2 Arylpiperazine derivatives and methods of utilizing same REVIVA PHARMACEUTICALS, INC. (US) 2016-02-09 US disclosed
US-20150166493-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME REVIVA PHARMACEUTICALS INC (US) 2015-06-18 US disclosed
US-8980883-B2 Arylpiperazine derivatives and methods of utilizing same REVIVA PHARMACEUTICALS, INC. (US) 2015-03-17 US disclosed
US-20150005298-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME REVIVA PHARMACEUTICALS INC (US) 2015-01-01 US disclosed
US-8859552-B2 Methods of utilizing arylpiperazine derivatives REVIVA PHARMACEUTICALS, INC. (US) 2014-10-14 US disclosed
US-20140155392-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES REVIVA PHARMACEUTICALS, INC. (US) 2014-06-05 US disclosed
US-8461154-B2 Methods of utilizing arylpiperazine derivatives REVIVA PHARMACEUTICALS, INC. (US) 2013-06-11 US disclosed
US-8431570-B2 Methods of utilizing arylpiperazine derivatives REVIVA PHARMACEUTICALS, INC. (US) 2013-04-30 US disclosed
US-20120220574-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES BHAT LAXMINARAYAN (US) 2012-08-30 US disclosed
US-20120220579-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES BHAT LAXMINARAYAN (US) 2012-08-30 US disclosed
US-8188076-B2 Compositions, synthesis, and methods of utilizing arylpiperazine derivatives REVIVA PHARMACEUTICALS, INC. (US) 2012-05-29 US disclosed
CN-102413830-A Compositions, synthesis and methods utilizing arylpiperazine derivatives REVIVA PHARMACEUTICALS INC 2012-04-11 CN disclosed
EP-2400968-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES Reviva Pharmaceuticals, Inc. (US) 2012-01-04 EP disclosed
WO-2010099502-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES REVIVA PHARMACEUTICALS, INC. (US) 2010-09-02 WO disclosed
US-20100216783-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES REVIVA PHARMACEUTICALS, INC. 2010-08-26 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 (8 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-20170327477-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME GRIK5, HTR5A, GRIK2 SLC6A2 253/4885SLC6A4 279/4885DRD2 27/4885
US-20160229821-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME GRIK5, HTR5A, GRIK2 SLC6A2 253/4885SLC6A4 279/4885DRD2 27/4885
US-20150005298-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME GRIK5, HTR5A, HTR2A SLC6A2 170/4885SLC6A4 152/4885DRD2 10/4885
US-20120220579-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES HTR5A, GRIK5, HTR2A SLC6A2 172/4885SLC6A4 124/4885DRD2 14/4885
US-20120220574-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES HTR5A, GRIK5, HTR2A SLC6A2 172/4885SLC6A4 124/4885DRD2 14/4885
US-20140155392-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES HTR5A, GRIK5, HTR2A SLC6A2 172/4885SLC6A4 124/4885DRD2 14/4885
US-20150166493-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME GRIK5, HTR5A, HTR2A SLC6A2 170/4885SLC6A4 152/4885DRD2 10/4885
US-20100216783-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES GRIK5, HTR5A, KYNU SLC6A2 589/4885SLC6A4 594/4885DRD2 18/4885

“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.