SCHEMBL375083

SCHEMBL375083

Cc1cccc(CN(C(=O)c2nc[nH]n2)C2CCOCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 4/20 0.46
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
SLC6A9 P48067 3/20 0.39
KCNH2 Q12809 2/20 0.39
SLC6A5 Q9Y345 2/20 0.39
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
MC4R P32245 1/20 0.37
MC5R P33032 1/20 0.37
MC3R P41968 1/20 0.37
SLC2A1 P11166 1/20 0.37
PDE2A O00408 1/20 0.37
ROCK2 O75116 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL375095 0.86 TACR1 (0.43) TACR1SLC6A9KCNH2SLC6A5SLC6A2
SCHEMBL375772 0.85 P2RX3 (0.42) TACR1SLC6A9KCNH2SLC6A5SLC2A1
SCHEMBL374835 0.85 SLC6A2 (0.40) TACR1KCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL374840 0.84 SLC6A9 (0.41) TACR1SLC6A9KCNH2SLC6A5SLC2A1
SCHEMBL375145 0.84 SLC6A4 (0.49) LMNAKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL375492 0.84 SLC6A9 (0.51) TACR1SLC6A9KCNH2SLC6A5ROCK2
SCHEMBL375594 0.83 KCNH2 (0.39) TACR1SLC6A9KCNH2SLC6A5SLC6A2
SCHEMBL375557 0.83 SLC6A9 (0.45) SLC6A9KCNH2ROCK2
SCHEMBL375116 0.82 KDM4E (0.40) TACR1SLC6A9KCNH2SLC6A5PDE2A
SCHEMBL375147 0.81 TACR1 (0.41) TACR1SLC6A9KCNH2SLC6A5SLC6A2

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 TACR1 158/4885LMNA 3715/4885TP53 4717/4885

“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.