SCHEMBL375123

SCHEMBL375123

Fc1ccc(CNC2CCOCC2)cc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 4/20 0.43
DUSP3 P51452 4/20 0.43
P2RX7 Q99572 3/20 0.42
WDR5 P61964 1/20 0.42
PARP1 P09874 1/20 0.42
OPRL1 P41146 2/20 0.42
EPHX1 P07099 1/20 0.41
MAP4K4 O95819 1/20 0.38
POLB P06746 1/20 0.38
MAPK10 P53779 1/20 0.38
CXCR3 P49682 1/20 0.38
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 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
SCHEMBL375105 0.84 KDM1A (0.48) PARP1OPRL1MAP4K4POLBPDCD1
SCHEMBL375074 0.81 POLB (0.47) PARP1OPRL1MAP4K4POLB
SCHEMBL375224 0.80 OPRL1 (0.42) P2RX7PARP1OPRL1
SCHEMBL374926 0.80 PARP1 (0.43) PARP1OPRL1MAP4K4POLBPDCD1
SCHEMBL2931633 0.77 TEAD1 (0.51) P2RX7WDR5EPHX1
SCHEMBL375334 0.77 ALDH1A1 (0.48) POLBPDCD1CD274
SCHEMBL20605181 0.77 PARP1 (0.41) WDR5PARP1OPRL1MAP4K4POLB
SCHEMBL375071 0.76 CARM1 (0.59) MAP4K4POLB
SCHEMBL17605614 0.76 BCHE (0.54) OPRL1MAP4K4POLB
SCHEMBL375092 0.75 DUT (0.43) PARP1OPRL1POLB

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 PTPN7 4533/4885DUSP3 4809/4885P2RX7 3738/4885

“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.