SCHEMBL2116174

SCHEMBL2116174

CC1CC(N2CCC([O])CC2)C1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 2/20 0.32
DHCR7 Q9UBM7 2/20 0.31
EBP Q15125 1/20 0.31
ALOX15 P16050 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
KDM2B Q8NHM5 1/20 0.30

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
SCHEMBL2117596 0.86 ALDH1A1 (0.37) KDM4EPOLBALDH1A1ALOX15KDM2B
SCHEMBL22737161 0.84 KDM4E (0.40) KDM4EPOLBALDH1A1DHCR7EBP
SCHEMBL2114244 0.82 ALDH1A1 (0.45) KDM4EPOLBALDH1A1SIGMAR1
SCHEMBL2116316 0.80 KDM4E (0.47) KDM4EPOLBALDH1A1DHCR7EBP
SCHEMBL2116176 0.78 CYP2C9 (0.36) KDM4EPOLBALDH1A1ALOX15
SCHEMBL12717986 0.78 L3MBTL3 (0.43) KDM4EPOLB
SCHEMBL25594643 0.76 OPRL1 (0.39) KDM4EPOLBDHCR7
SCHEMBL12715134 0.76 L3MBTL3 (0.34) KDM4EALDH1A1
SCHEMBL21363769 0.76
SCHEMBL12716792 0.76 L3MBTL3 (0.34) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158652-B2 1-Difluoromethyl-5-{4-[3-(1-piperidinyl)propoxy]phenyl}-2(1H)-pyridone; compounds act as histamine-H3 receptor antagonistic substances or inverse-agonistic substances; useful as preventives or remedies for various circular system diseases, nervous system diseases, metabolic system diseases MSD K.K. (JP) 2012-04-17 US disclosed
US-20080269287-A1 Substituted Pyridone Derivative MSD K.K. (JP) 2008-10-30 US disclosed
EP-1820797-A1 SUBSTITUTED PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-22 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 (1 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-20080269287-A1 Substituted Pyridone Derivative HRH3, HRH4, HRH1 KDM4E 368/4885POLB 3462/4885ALDH1A1 596/4885

“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.