SCHEMBL14432644

SCHEMBL14432644

CC(=O)NC[C@H]1CN(c2ccc(-c3ccc([C@H](O)CN(C)C(C)=O)cc3)c(F)c2)C(=O)O1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 5/20 0.58
▸ CALML3 P27482 7/20 0.55
▸ MAOB P27338 2/20 0.55
▸ LMNA P02545 1/20 0.55
▸ PTGS1 P23219 1/20 0.55
▸ SDHA P31040 1/20 0.55
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47

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
SCHEMBL1393183 0.88 MAOA (0.53) MAOACALML3MAOBLMNAPTGS1
SCHEMBL1393880 0.88 MAOA (0.53) MAOACALML3MAOBLMNAPTGS1
SCHEMBL1393882 0.88 MAOA (0.53) MAOACALML3MAOBLMNAPTGS1
SCHEMBL12075302 0.87 MAOA (0.52) MAOACALML3MAOBLMNAPTGS1
SCHEMBL1394259 0.86 MAOA (0.57) MAOACALML3MAOBLMNAPTGS1
SCHEMBL14026448 0.86 MAOA (0.57) MAOACALML3MAOBLMNAPTGS1
SCHEMBL7938091 0.85 MAOA (0.65) MAOACALML3MAOBLMNAPTGS1
SCHEMBL6023183 0.85 MAOA (0.56) MAOACALML3MAOBLMNAPTGS1
SCHEMBL1394850 0.85 MAOA (0.64) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3179763 0.85 MAOA (0.56) MAOACALML3MAOBLMNAPTGS1

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-20070197541-A1 Biaryl heterocyclic amines,amides, and sulfur-containing compounds and methods of making and using the same RIB-X PHARMACEUTICALS, INC. 2007-08-23 — — US disclosed
US-20070197541-A1 Biaryl heterocyclic amines,amides, and sulfur-containing compounds and methods of making and using the same RIB-X PHARMACEUTICALS, INC. 2007-08-23 — — 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-20070197541-A1 Biaryl heterocyclic amines,amides, and sulfur-containing compounds and methods of making and using the same SQOR, AADAC, TST MAOA 605/4885CALML3 2657/4885MAOB 685/4885

“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.

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