SCHEMBL760272

SCHEMBL760272

Cc1ccc(N2CCC3(CC2)CNC(=O)O3)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
CHRM2 P08172 1/20 0.49
ADRA2A P08913 1/20 0.49
CYP2D6 P10635 1/20 0.49
TSHR P16473 1/20 0.49
DRD1 P21728 1/20 0.49
SMO Q99835 1/20 0.48
MAPT P10636 2/20 0.48
KMT2A Q03164 1/20 0.48
EED O75530 1/20 0.48
ADRB1 P08588 1/20 0.44
CDK8 P49336 6/20 0.43
CDK19 Q9BWU1 6/20 0.43
CCNC P24863 4/20 0.43
CYP11B2 P19099 1/20 0.42
HDAC1 Q13547 1/20 0.40
HTR7 P34969 1/20 0.40
DRD2 P14416 2/20 0.39
DRD4 P21917 2/20 0.39
DRD3 P35462 2/20 0.39

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
SCHEMBL737636 0.85 LMNA (0.49) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL6683284 0.85 CYP2D6 (0.62) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL736895 0.85 HTR3E (0.48) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL761450 0.80 LRRK2 (0.43) MAPTKMT2AADRB1HTR7DRD2
SCHEMBL13211932 0.78 GABRD (0.54) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL14817982 0.76 ALDH1A1 (0.50) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL20644693 0.74 CDK8 (0.54) LMNACHRM2ADRA2ACYP2D6TSHR
SCHEMBL737588 0.74 HRH3 (0.49)
SCHEMBL17543949 0.74 ADRB1 (0.50) TSHRMAPTKMT2AADRB1AKR1C3
SCHEMBL1096010 0.74 LMNA (0.55) LMNACHRM2ADRA2ACYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138206-B2 Piperidine derivative MSD. K.K. (JP) 2012-03-20 US disclosed
US-20090137576-A1 Novel Piperidine Derivative MSD K.K. (JP) 2009-05-28 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 (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-20090137576-A1 Novel Piperidine Derivative HRH4, HRH3, HRH1 LMNA 4494/4885CHRM2 10/4885ADRA2A 208/4885

“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.