SCHEMBL13533366

SCHEMBL13533366

CC(C)CCCOc1ccc2c(c1)OCCCO2

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 14/20 0.57
MAOA P21397 8/20 0.57
TSHR P16473 1/20 0.54
MAPT P10636 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
THRB P10828 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41

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
SCHEMBL13533369 0.95 MAOB (0.62) MAOBMAOATSHRMAPTALDH1A1
SCHEMBL13533384 0.93 MAOB (0.59) MAOBMAOATSHRMEN1KMT2A
SCHEMBL13251240 0.88 MAOB (0.60) MAOBMAOATSHRMAPTMEN1
SCHEMBL13533381 0.88 MAOB (0.64) MAOBMAOATSHRMAPK1
SCHEMBL13533371 0.85 MAOB (0.43) MAOBMAOATSHRSMN1; SMN2
SCHEMBL13533374 0.83 MAOB (0.43) MAOBMAOATSHRSMN1; SMN2
SCHEMBL13533377 0.83 MAOB (0.50) MAOBMAOATSHRMAPTMEN1
SCHEMBL13534217 0.81 MAOB (0.59) MAOBMAOATSHRMAPTALDH1A1
SCHEMBL13533368 0.81 MAOB (0.46) MAOBMAOATSHR
SCHEMBL13533386 0.80 MAOB (0.62) MAOBMAOATSHRMAPTMEN1

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-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 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-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS HTR6, GAP43, HTR5A MAOB 306/4885MAOA 296/4885TSHR 313/4885

“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.