SCHEMBL4382670

SCHEMBL4382670

CCCCCNC(C)C(O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.65
ALDH1A1 P00352 5/20 0.65
CYP2D6 P10635 4/20 0.65
CYP2C19 P33261 3/20 0.65
KMT2A Q03164 3/20 0.65
NPSR1 Q6W5P4 3/20 0.65
ADRA1A P35348 3/20 0.65
SLC6A4 P31645 3/20 0.65
CHRM2 P08172 2/20 0.65
CYP3A4 P08684 2/20 0.65
CYP2C9 P11712 2/20 0.65
ALOX15 P16050 2/20 0.65
TSHR P16473 2/20 0.65
ADRA2C P18825 2/20 0.65
MEN1 O00255 2/20 0.65
MAPK1 P28482 2/20 0.65
CYP1A2 P05177 2/20 0.65
SLC6A2 P23975 2/20 0.65
OPRM1 P35372 2/20 0.65
SLC6A3 Q01959 2/20 0.65

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
SCHEMBL8644590 0.98 LMNA (0.68) LMNAALDH1A1CYP2D6CYP2C19KMT2A
SCHEMBL16784192 0.98 LMNA (0.68) LMNAALDH1A1CYP2D6CYP2C19KMT2A
SCHEMBL27713482 0.98 LMNA (0.68) LMNAALDH1A1CYP2D6CYP2C19KMT2A
Hydrochloric Acid SCHEMBL4931174 0.97 LMNA (0.66) LMNAALDH1A1CYP2D6CYP2C19KMT2A
Hydrochloric Acid SCHEMBL4924515 0.97 LMNA (0.66) LMNAALDH1A1CYP2D6CYP2C19KMT2A
SCHEMBL11299290 0.95 ALDH1A1 (0.60) LMNAALDH1A1CYP2D6CYP2C19KMT2A
SCHEMBL20689721 0.91 CYP2D6 (0.58) LMNAALDH1A1CYP2D6CYP2C19KMT2A
SCHEMBL20689716 0.91 CYP2D6 (0.58) LMNAALDH1A1CYP2D6CYP2C19KMT2A
SCHEMBL22461952 0.88 CYP2D6 (0.58) LMNAALDH1A1CYP2D6CYP2C19KMT2A
SCHEMBL13990579 0.88 CYP2D6 (0.58) LMNAALDH1A1CYP2D6CYP2C19KMT2A

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-20090054526-A1 INHIBITORS OF ANOREXIC LIPID HYDROLYSIS FOR THE TREATMENT OF EATING DISORDERS UNIVERSITY OF COPENHAGEN (DK) 2009-02-26 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-20090054526-A1 INHIBITORS OF ANOREXIC LIPID HYDROLYSIS FOR THE TREATMENT OF EATING DISORDERS LIPE, PNLIP, FAAH2 LMNA 2910/4885ALDH1A1 1720/4885CYP2D6 2603/4885

“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.