SCHEMBL8224031

SCHEMBL8224031

CC(C)c1cnc(N(Cc2ccccc2)Cc2ccccc2)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2B P18089 2/20 0.43
ADRA2C P18825 2/20 0.43
SLC6A2 P23975 2/20 0.43
HTR2A P28223 2/20 0.43
SLC6A4 P31645 2/20 0.43
ADRA1A P35348 2/20 0.43
OPRK1 P41145 2/20 0.43
SLC6A3 Q01959 2/20 0.43
KCNH2 Q12809 2/20 0.43
CHRM2 P08172 1/20 0.43
ADRA2A P08913 1/20 0.43
DRD1 P21728 1/20 0.43
HRH1 P35367 1/20 0.43
LMNA P02545 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TSHR P16473 3/20 0.42
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 1/20 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
SCHEMBL19105550 0.85 ALDH1A1 (0.42) ADRA2BADRA2CSLC6A2HTR2ASLC6A4
SCHEMBL8422447 0.80 CYP2C19 (0.53) ADRA2BADRA2CSLC6A2HTR2ASLC6A4
SCHEMBL15071812 0.80 GBA1 (0.46) ADRA2BADRA2CSLC6A2HTR2ASLC6A4
SCHEMBL16310946 0.73 CAPN1 (0.44) HTR2ALMNAAOC3TAAR1
SCHEMBL29957104 0.72 CXCR1 (0.52) ADRA2BADRA2CSLC6A2HTR2ASLC6A4
SCHEMBL12609970 0.72 TSHR (0.64) ADRA2BADRA2CSLC6A2HTR2ASLC6A4
SCHEMBL12794282 0.71 HDAC6 (0.47) MAPK1TSHRCYP2C19MEN1KMT2A
SCHEMBL19117565 0.70 NPC1 (0.61) ALDH1A1MEN1KMT2A
SCHEMBL12774503 0.69 CRHBP (0.54) ADRA2BADRA2CSLC6A2HTR2ASLC6A4
SCHEMBL13561359 0.68 HTR2B (0.44) LMNAALDH1A1CNR2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant SCHERING CORPORATION 2007-06-21 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-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant CNR2, GPR119, GLP1R ADRA2B 106/4885ADRA2C 71/4885SLC6A2 195/4885

“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.