Xylamidine

Xylamidine

SCHEMBL30201100

COc1cccc(OC(C)CNC(=N)Cc2cccc(C)c2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 13/20 0.53
MTNR1B P49286 13/20 0.53
MAOB P27338 1/20 0.40
ORAI1 Q96D31 1/20 0.39
LMNA P02545 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CTBP2 P56545 1/20 0.38

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
Xylamidine SCHEMBL31307218 0.92 MTNR1A (0.58) MTNR1AMTNR1BMAOBLMNAALDH1A1
Xylamidine SCHEMBL123846 0.84 MTNR1A (0.50) MTNR1AMTNR1BMAOBALDH1A1
SCHEMBL30201287 0.75 MTNR1A (0.56) MTNR1AMTNR1BALDH1A1
SCHEMBL31231248 0.73 MTNR1A (0.48) MTNR1AMTNR1BLMNAALDH1A1
SCHEMBL30200767 0.71 MTNR1A (0.42) MTNR1AMTNR1BLMNAALDH1A1
1,3-Dimethoxybenzene SCHEMBL11452224 0.70 LMNA (0.58) MTNR1AMTNR1BLMNA
SCHEMBL30201095 0.70 MTNR1A (0.52) MTNR1AMTNR1BLMNAALDH1A1
SCHEMBL31231364 0.70 MTNR1A (0.56) MTNR1AMTNR1BLMNAALDH1A1
Trifluoroacetic Acid SCHEMBL5658158 0.69 CTBP2 (0.55) CTBP2
Xylamidine SCHEMBL2107805 0.68 MAOB (0.47) MTNR1AMTNR1BMAOBCTBP2

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-20240390301-A1 COMBINATIONS OF PERIPHERAL 5-HT2A RECEPTOR ANTAGONISTS AND CENTRAL 5-HT2A RECEPTOR AGONISTS GILGAMESH PHARMACEUTICALS, INC. (US) 2024-11-28 US disclosed
WO-2023028086-A1 COMBINATIONS OF PERIPHERAL 5-HT2A RECEPTOR ANTAGONISTS AND CENTRAL 5-HT2A RECEPTOR AGONISTS GILGAMESH PHARMACEUTICALS, INC. (US) 2023-03-02 WO 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-20240390301-A1 COMBINATIONS OF PERIPHERAL 5-HT2A RECEPTOR ANTAGONISTS AND CENTRAL 5-HT2A RECEPTOR AGONISTS HTR2A, HTR2C, HTR5A MTNR1A 84/4885MTNR1B 57/4885MAOB 169/4885

“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.