SCHEMBL375105

SCHEMBL375105

Fc1ccc(CNC2CCOCC2)cc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.48
PARP1 P09874 1/20 0.46
PDE2A O00408 1/20 0.46
OPRL1 P41146 3/20 0.43
POLB P06746 1/20 0.42
MAP4K4 O95819 2/20 0.41
HRH3 Q9Y5N1 1/20 0.41
SSTR3 P32745 1/20 0.41
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
EPAS1 Q99814 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRK1 P41145 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL375074 0.88 POLB (0.47) PARP1OPRL1POLBMAP4K4SSTR3
SCHEMBL374926 0.86 PARP1 (0.43) KDM1APARP1PDE2AOPRL1POLB
SCHEMBL375123 0.84 PTPN7 (0.43) PARP1OPRL1POLBMAP4K4PDCD1
SCHEMBL375334 0.83 ALDH1A1 (0.48) KDM1APOLBPDCD1CD274HTT
SCHEMBL20605181 0.83 PARP1 (0.41) KDM1APARP1OPRL1POLBMAP4K4
SCHEMBL17605614 0.81 BCHE (0.54) KDM1AOPRL1POLBMAP4K4HRH3
SCHEMBL3633900 0.81 KDM1A (0.48) KDM1APOLBHRH3SSTR3MEN1
SCHEMBL375224 0.81 OPRL1 (0.42) PARP1OPRL1EPAS1HTT
SCHEMBL375092 0.81 DUT (0.43) PARP1OPRL1POLBHRH3EPAS1
SCHEMBL375084 0.80 OPRL1 (0.44) KDM1APARP1OPRL1MAP4K4HTT

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 KDM1A 4445/4885PARP1 4575/4885PDE2A 1638/4885

“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.