SCHEMBL20032484

SCHEMBL20032484

CCCC(CC)c1ccc(Cl)cc1-c1cccc(OC)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.44
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
FFAR1 O14842 1/20 0.41
CNR1 P21554 2/20 0.40
GCGR P47871 1/20 0.39
MAPK14 Q16539 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
CYP17A1 P05093 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
DPP4 P27487 1/20 0.38
IDO1 P14902 1/20 0.38
STK10 O94804 1/20 0.37
GSK3B P49841 1/20 0.37
SLK Q9H2G2 1/20 0.37
CNR2 P34972 1/20 0.37

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
SCHEMBL18713726 0.92 MAOB (0.47) MAOBPDE4APDE4BPDE4CPDE4D
SCHEMBL20032144 0.90 FNTA (0.41) PDE4APDE4BPDE4CPDE4DFFAR1
SCHEMBL20032498 0.88 CNR1 (0.45) MAOBFFAR1CNR1FNTAFNTB
SCHEMBL21366933 0.83 SLC6A4 (0.34) FFAR1
SCHEMBL20032433 0.83 PTGDR2 (0.38) FFAR1CYP17A1
SCHEMBL20032368 0.82 ALDH1A1 (0.38) CNR1CNR2TP53MAPT
SCHEMBL20032373 0.82 KCNH2 (0.38) CNR1DPP4MAPT
SCHEMBL18713737 0.82 FNTA (0.43) FNTAFNTBTP53MAPTTDP1
SCHEMBL20032364 0.80 MRGPRX4 (0.36) PDE4BFFAR1
SCHEMBL20032496 0.80 KIF11 (0.35) FFAR1CNR1IDO1

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-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2018-04-05 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-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A MAOB 215/4885PDE4A 2320/4885PDE4B 3221/4885

“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.