SCHEMBL3587290

SCHEMBL3587290

NCCCC(N)CSc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.53
MAOB P27338 1/20 0.53
HRH1 P35367 2/20 0.47
HTR2A P28223 1/20 0.47
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 1/20 0.40
MTNR1A P48039 3/20 0.37
MTNR1B P49286 3/20 0.37
FFAR1 O14842 1/20 0.34
BACE1 P56817 1/20 0.34
KIF11 P52732 1/20 0.33
EPHX1 P07099 1/20 0.33

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
Dimethylamine SCHEMBL554509 0.82 MAOA (0.55) MAOAMAOBHRH1ALDH1A1MAPK1
SCHEMBL14223692 0.82 MAOA (0.50) MAOAMAOBALDH1A1MAPK1MTNR1A
SCHEMBL3441777 0.80 MAOA (0.61) MAOAMAOBHTR2AALDH1A1MAPK1
SCHEMBL10798872 0.80 MAOA (0.47) MAOAMAOBHRH1HTR2AALDH1A1
SCHEMBL26648419 0.79 MAOA (0.60) MAOAMAOBALDH1A1MAPK1MTNR1A
SCHEMBL14223690 0.79 MAOA (0.60) MAOAMAOBALDH1A1MAPK1MTNR1A
Hydrochloric Acid SCHEMBL10795186 0.79 MAOA (0.46) MAOAMAOBHRH1HTR2AALDH1A1
SCHEMBL376197 0.78 MAOA (0.50) MAOAMAOBHRH1HTR2AALDH1A1
SCHEMBL13269950 0.76 MAOA (0.56) MAOAMAOBALDH1A1MAPK1MTNR1A
SCHEMBL3590718 0.75 HTR2A (0.44) MAOAHRH1HTR2AEPHX1

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-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 Wurster, Siegfried (FI) 2010-02-25 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-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 SSTR1, SSTR4, SSTR3 MAOA 3631/4885MAOB 2725/4885HRH1 446/4885

“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.