SCHEMBL5987763

SCHEMBL5987763

CC(=O)NCCCc1ccc(CCl)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.58
F13A1 P00488 1/20 0.58
MTNR1A P48039 2/20 0.55
MTNR1B P49286 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.53
ALDH1A1 P00352 3/20 0.49
MAPT P10636 2/20 0.49
HIF1A Q16665 2/20 0.49
POLB P06746 2/20 0.49
RAB9A P51151 1/20 0.49
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
PTGS1 P23219 1/20 0.49
BLM P54132 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MAPK1 P28482 1/20 0.48
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL5567452 0.91 KDM4E (0.70) KDM4EF13A1SMN1; SMN2ALDH1A1MAPT
SCHEMBL2167338 0.85 KDM4E (0.79) KDM4EF13A1MTNR1AMTNR1BSMN1; SMN2
SCHEMBL5987412 0.85 KDM4E (0.58) KDM4EF13A1MTNR1AMTNR1BSMN1; SMN2
SCHEMBL11554729 0.85 KDM4E (0.58) KDM4EF13A1MTNR1AMTNR1BSMN1; SMN2
SCHEMBL5378328 0.84 NPC1 (0.58) KDM4EF13A1MTNR1AMTNR1BSMN1; SMN2
SCHEMBL422827 0.83 L3MBTL1 (0.68) KDM4EMTNR1AMTNR1BSMN1; SMN2POLB
SCHEMBL5987106 0.81 KDM4E (0.53) KDM4EF13A1MTNR1AMTNR1BSMN1; SMN2
SCHEMBL27446239 0.81 SMN1; SMN2 (0.81) MTNR1AMTNR1BSMN1; SMN2POLB
SCHEMBL5707308 0.80 KDM4E (0.77) KDM4EF13A1MTNR1AMTNR1BSMN1; SMN2
SCHEMBL10592850 0.80 KDM4E (0.84) KDM4EF13A1MTNR1AMTNR1BSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060167014-A1 Piperazine compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION 2006-07-27 US disclosed
EP-1029851-B1 PIPERAZINE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2005-04-20 EP disclosed
US-20030055064-A1 Piperazine compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION 2003-03-20 US disclosed
US-20030018034-A1 Piperazine compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION 2003-01-23 US disclosed
US-6455528-B1 TUMOR NECROSIS FACTOR ANTAGONIST AND/OR INTERLEUKIN PROMOTER; ANTIALLERGENS, ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASE TREATMENT MITSUBISHI PHARMA CORPORATION (JP) 2002-09-24 US disclosed
EP-1029851-A1 PIPERAZINE COMPOUNDS AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2000-08-23 EP 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-20030055064-A1 Piperazine compounds and medicinal use thereof TNF, IL5, CCR10 KDM4E 2185/4885F13A1 2343/4885MTNR1A 2349/4885
US-20030018034-A1 Piperazine compounds and medicinal use thereof TNF, IL5, CCR10 KDM4E 2169/4885F13A1 2369/4885MTNR1A 2433/4885
US-20060167014-A1 Piperazine compounds and medicinal use thereof TNF, CCR10, RELA KDM4E 1862/4885F13A1 2178/4885MTNR1A 2634/4885

“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.