SCHEMBL5228097

SCHEMBL5228097

CC(=O)NN1CCNCC1c1c(C)cccc1C

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 13/20 0.40
HTR2B P41595 13/20 0.40
HTR2A P28223 9/20 0.40
ADRB1 P08588 1/20 0.37
HRH4 Q9H3N8 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL2650583 0.76 HTR2C (0.41) HTR2CHTR2BHTR2AADRB1
SCHEMBL1923622 0.73 HTR2C (0.40) HTR2CHTR2BHTR2AADRB1
SCHEMBL8730096 0.70 SLC6A4 (0.55) KMT2A
SCHEMBL6128340 0.67 CHRNB2 (0.44) ALDH1A1GAAMAPTHTTSMN1; SMN2
SCHEMBL4574778 0.66 DPP4 (0.34)
SCHEMBL6015072 0.64 HTR2C (0.43) HTR2CHTR2BHTR2AADRB1
SCHEMBL18284815 0.64 TAAR1 (0.44) HTR2CHTR2BHTR2A
SCHEMBL15830018 0.63 PRMT5 (0.46) ALDH1A1
SCHEMBL15824978 0.63 TAAR1 (0.43) HTR2CHTR2BHTR2A
SCHEMBL11006977 0.63 POLB (0.35) HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2586774-A1 METHOD FOR PREPARATION OF RANOLAZINE Shanghai Kuoikee Laboratories Co., Ltd (CN) 2013-05-01 EP claimed
US-20130090475-A1 Process for the Preparation of Ranolazine ZHEJIANG JIANFENG HAIZHOU PHARMACEUTICAL CO., LTD. (CN) 2013-04-11 US claimed
EP-2586774-A1 METHOD FOR PREPARATION OF RANOLAZINE Shanghai Kuoikee Laboratories Co., Ltd (CN) 2013-05-01 EP disclosed
US-20130090475-A1 Process for the Preparation of Ranolazine ZHEJIANG JIANFENG HAIZHOU PHARMACEUTICAL CO., LTD. (CN) 2013-04-11 US disclosed
WO-2011160396-A1 METHOD FOR PREPARATION OF RANOLAZINE 上海冠杰生物医药科技有限公司 (CN) 2011-12-29 WO disclosed
EP-1339701-B1 HETEROARYL ALKYL PIPERAZINE DERIVATIVES AS FATTY ACID OXIDATION INHIBITORS CV THERAPEUTICS INC (US) 2007-02-14 EP disclosed
US-6849632-B2 Heteroaryl alkyl piperazine derivatives CV THERAPEUTICS, INC. (US) 2005-02-01 US disclosed
US-20040192702-A1 Heteroaryl alkyl piperazine derivatives ZABLOCKI JEFF (US) 2004-09-30 US disclosed
US-20040029889-A1 Heteroaryl alkyl piperazine derivatives as fatty acid oxidation inhibitors CV THERAPEUTICS, INC. 2004-02-12 US disclosed
US-20030216409-A1 Heteroaryl alkyl piperazine derivatives CV THERAPEUTICS, INC. 2003-11-20 US disclosed
EP-1339701-A1 HETEROARYL ALKYL PIPERAZINE DERIVATIVES AS FATTY ACID OXIDATION INHIBITORS CV THERAPEUTICS, INC. (US) 2003-09-03 EP disclosed
US-6573264-B1 Protecting skeletal muscles against damage, treating shock conditions, preserving donor tissue and organs used in transplants, treating cardiovascular diseases CV THERAPEUTICS, INC. 2003-06-03 US disclosed
WO-2002064576-A1 HETEROARYL ALKYL PIPERAZINE DERIVATIVES AS FATTY ACID OXIDATION INHIBITORS CV THERAPEUTICS, INC. (US) 2002-08-22 WO 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 (4 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-20040029889-A1 Heteroaryl alkyl piperazine derivatives as fatty acid oxidation inhibitors CPT1B, CPT1A, ALOX15 HTR2C 3752/4885HTR2B 3873/4885HTR2A 3260/4885
US-20040192702-A1 Heteroaryl alkyl piperazine derivatives ATP2A1, CPT1B, ATP2A3 HTR2C 4175/4885HTR2B 4364/4885HTR2A 3772/4885
US-20030216409-A1 Heteroaryl alkyl piperazine derivatives ATP2A1, CPT1B, ATP2A3 HTR2C 4175/4885HTR2B 4364/4885HTR2A 3772/4885
US-20130090475-A1 Process for the Preparation of Ranolazine RANBP1, RANBP2, RAN HTR2C 1246/4885HTR2B 2278/4885HTR2A 1309/4885

“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.