SCHEMBL6090666

SCHEMBL6090666

CN(C)c1ccc(C=CC(=O)C23CC4CC(CC(C4)C2)C3)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.55
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
TLR9 Q9NR96 1/20 0.47
MAPT P10636 4/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 3/20 0.45
MAOB P27338 3/20 0.45
NPC1 O15118 2/20 0.45
MAOA P21397 2/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HDAC3 O15379 2/20 0.44

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
SCHEMBL6092094 0.81 HSD11B1 (0.51) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL6090902 0.81 CYP1A2 (0.51) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL8876584 0.81 HSD11B1 (0.51) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL18317450 0.81 ALDH1A1 (0.45) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL18325433 0.81 ALDH1A1 (0.45) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL12040547 0.80 GABBR2 (0.53) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL6091145 0.80 GABBR2 (0.53) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL6093071 0.80 LMNA (0.47) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL6093043 0.80 KDM4E (0.54) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL6093637 0.80 F3 (0.55) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1

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-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 US claimed
US-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 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-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders PMP22, ADCYAP1R1, CYP11B2 HSD17B3 75/4885CRHBP 505/4885CRHR2 17/4885

“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.