SCHEMBL2962615

SCHEMBL2962615

CC(CN1CCN(Cc2cc3c(cc2Cl)OCO3)CC1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GFER P55789 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
OPRM1 P35372 6/20 0.47
OPRD1 P41143 6/20 0.47
OPRK1 P41145 6/20 0.47
OPRL1 P41146 5/20 0.47
DRD3 P35462 3/20 0.47
SIGMAR1 Q99720 2/20 0.47
CACNA1F O60840 2/20 0.47
CACNA1D Q01668 2/20 0.47
CACNA1S Q13698 2/20 0.47
CACNA1C Q13936 2/20 0.47
GAA P10253 1/20 0.45
CHRM1 P11229 2/20 0.45
ADRA1D P25100 2/20 0.45
HTR7 P34969 2/20 0.45

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
SCHEMBL13150189 0.85 MEN1 (0.49) MEN1KMT2AOPRM1OPRD1OPRK1
SCHEMBL2961160 0.81 EPHX2 (0.54) MEN1KMT2AKDM4EALDH1A1OPRM1
SCHEMBL13150855 0.76 HTR7 (0.55) MEN1KMT2AALDH1A1OPRM1OPRD1
SCHEMBL13149628 0.76 KMT2A (0.57) MEN1KMT2AKDM4EALDH1A1OPRM1
SCHEMBL13150247 0.74 KMT2A (0.66) MEN1KMT2AKDM4EALDH1A1SIGMAR1
SCHEMBL13926092 0.73 LMNA (0.46) MEN1KMT2AOPRM1OPRD1OPRK1
SCHEMBL2952419 0.73 MEN1 (0.49) MEN1KMT2AOPRM1OPRD1OPRK1
SCHEMBL8354133 0.69 ALDH1A1 (0.70) KMT2AKDM4EALDH1A1GFERL3MBTL1
SCHEMBL13150209 0.69 MEN1 (0.53) MEN1KMT2AALDH1A1OPRM1OPRD1
SCHEMBL14939360 0.69 NPSR1 (0.63) MEN1KMT2AALDH1A1OPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130072497-A1 N- SUBSTITUTED PIPERAZINES DOW AGROSCIENCES LLC (US) 2013-03-21 US disclosed
US-20130072497-A1 N- SUBSTITUTED PIPERAZINES DOW AGROSCIENCES LLC (US) 2013-03-21 US disclosed
US-20130072497-A1 N- SUBSTITUTED PIPERAZINES DOW AGROSCIENCES LLC (US) 2013-03-21 US disclosed
US-8338430-B2 N-substituted piperazines DOW AGROSCIENCES, LLC. (US) 2012-12-25 US disclosed
US-8338430-B2 N-substituted piperazines DOW AGROSCIENCES, LLC. (US) 2012-12-25 US disclosed
US-8338430-B2 N-substituted piperazines DOW AGROSCIENCES, LLC. (US) 2012-12-25 US disclosed
US-20100234391-A1 N-SUBSTITUTED PIPERAZINES DOW AGROSCIENCES LLC (US) 2010-09-16 US disclosed
US-20100234391-A1 N-SUBSTITUTED PIPERAZINES DOW AGROSCIENCES LLC (US) 2010-09-16 US disclosed
US-20100234391-A1 N-SUBSTITUTED PIPERAZINES DOW AGROSCIENCES LLC (US) 2010-09-16 US disclosed
US-7754724-B2 N-substituted piperazines DOW AGROSCIENCES LLC (US) 2010-07-13 US disclosed
US-7754724-B2 N-substituted piperazines DOW AGROSCIENCES LLC (US) 2010-07-13 US disclosed
US-7754724-B2 N-substituted piperazines DOW AGROSCIENCES LLC (US) 2010-07-13 US disclosed
US-20070004750-A1 N-substituted piperazines CORTEVA AGRISCIENCE LLC 2007-01-04 US disclosed
US-20070004750-A1 N-substituted piperazines CORTEVA AGRISCIENCE LLC 2007-01-04 US disclosed
US-20070004750-A1 N-substituted piperazines CORTEVA AGRISCIENCE LLC 2007-01-04 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-20070004750-A1 N-substituted piperazines PRXL2A, CNPY2, CYP4X1 MEN1 3085/4885KMT2A 558/4885KDM4E 280/4885
US-20100234391-A1 N-SUBSTITUTED PIPERAZINES PRXL2A, CNPY2, CYP4X1 MEN1 3085/4885KMT2A 558/4885KDM4E 280/4885
US-20130072497-A1 N- SUBSTITUTED PIPERAZINES PRXL2A, CNPY2, CYP4X1 MEN1 3085/4885KMT2A 558/4885KDM4E 280/4885

“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.