SCHEMBL375157

SCHEMBL375157

c1ccc(-c2ccc(CNC3CCOCC3)cc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.75
KMT2A Q03164 2/20 0.75
RAB9A P51151 1/20 0.75
HRH3 Q9Y5N1 2/20 0.59
OPRM1 P35372 3/20 0.55
OPRK1 P41145 3/20 0.55
GRIN2B Q13224 1/20 0.51
KDM1A O60341 1/20 0.50
PDCD1 Q15116 1/20 0.49
CD274 Q9NZQ7 1/20 0.49
SLC2A1 P11166 1/20 0.49
HDAC1 Q13547 2/20 0.48
HTR5A P47898 2/20 0.48
ACHE P22303 3/20 0.47
BACE1 P56817 3/20 0.47
BCHE P06276 2/20 0.47
TGFBR1 P36897 1/20 0.47
PRKD1 Q15139 1/20 0.46

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
SCHEMBL375264 0.90 GRIN2B (0.62) MEN1KMT2ARAB9AHRH3OPRM1
SCHEMBL1547169 0.88 MEN1 (0.96) MEN1KMT2ARAB9AHRH3GRIN2B
SCHEMBL16249332 0.84 MEN1 (0.83) MEN1KMT2ARAB9AHRH3OPRM1
SCHEMBL24093171 0.83 HRH3 (0.86) MEN1KMT2ARAB9AHRH3OPRM1
SCHEMBL8809487 0.83 HRH3 (0.86) MEN1KMT2ARAB9AHRH3OPRM1
SCHEMBL29577700 0.80 MEN1 (0.81) MEN1KMT2ARAB9AHRH3GRIN2B
SCHEMBL17605614 0.79 BCHE (0.54) MEN1KMT2ARAB9AHRH3OPRM1
SCHEMBL379455 0.79 HRH3 (0.49) MEN1KMT2ARAB9AHRH3OPRM1
SCHEMBL25033800 0.79 HRH3 (0.49) MEN1KMT2ARAB9AHRH3OPRM1
SCHEMBL14848246 0.79 ACHE (0.54) MEN1KMT2ARAB9AHRH3OPRM1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8623898-B2 Glycine transporter inhibiting substances TAISHO PHARMACEUTICAL CO., LTD. (JP) 2014-01-07 US disclosed
EP-2409976-A1 GLYCINE TRANSPORTER INHIBITOR Taisho Pharmaceutical Co., Ltd. (JP) 2012-01-25 EP disclosed
US-20120010414-A1 GLYCINE TRANSPORTER INHIBITING SUBSTANCES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-12 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-20120010414-A1 GLYCINE TRANSPORTER INHIBITING SUBSTANCES SLC18A2, SLC1A2, SLC6A1 MEN1 2688/4885KMT2A 3137/4885RAB9A 898/4885

“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.