SCHEMBL13050344

SCHEMBL13050344

CC(C)(C)COc1ccccc1Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 11/20 0.57
DRD1 P21728 6/20 0.57
DRD4 P21917 5/20 0.57
DRD5 P21918 5/20 0.57
DRD2 P14416 4/20 0.57
HPGD P15428 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
TP53 P04637 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
TSHR P16473 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
DRD3 P35462 4/20 0.54
LMNA P02545 1/20 0.54
HTR1A P08908 1/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48

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
SCHEMBL24440184 0.82 LMNA (0.52) HRH1DRD1DRD4DRD5DRD2
SCHEMBL12129191 0.79 DRD1 (0.63) HRH1DRD1DRD4DRD5DRD2
SCHEMBL18997033 0.79 L3MBTL1 (0.56) HPGDSMN1; SMN2TSHRL3MBTL1
SCHEMBL13449767 0.78 KDM4E (0.41) SMN1; SMN2L3MBTL1LMNA
SCHEMBL12251017 0.78 RIPK1 (0.44) L3MBTL1
SCHEMBL12250933 0.78 MAPT (0.58) DRD2L3MBTL1HTR1AADRA1DADRA1A
SCHEMBL2228334 0.78 RIPK1 (0.44) DRD1DRD4DRD5DRD2L3MBTL1
SCHEMBL10601013 0.77 DRD2 (0.69) HRH1DRD1DRD4DRD5DRD2
SCHEMBL5248169 0.76 DRD1 (0.69) HRH1DRD1DRD4DRD5DRD2
SCHEMBL12772057 0.76 HRH1 (0.58) HRH1DRD1DRD4DRD5DRD2

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-20100292289-A1 TREATMENT OF METABOLIC SYNDROME WITH NOVEL AMIDES AMPLA PHARMACEUTICALS INC. (US) 2010-11-18 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-20100292289-A1 TREATMENT OF METABOLIC SYNDROME WITH NOVEL AMIDES GPR119, CPT1A, GLS2 HRH1 2101/4885DRD1 3790/4885DRD4 4303/4885

“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.