SCHEMBL375045

SCHEMBL375045

FC(F)(F)Oc1cccc(CNCC2CCOCC2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLS O94925 3/20 0.57
PIM1 P11309 3/20 0.50
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
CNR2 P34972 1/20 0.47
PIM2 Q9P1W9 1/20 0.47
CARM1 Q86X55 3/20 0.46
PRMT6 Q96LA8 2/20 0.46
MAPK14 Q16539 1/20 0.45
CHRM4 P08173 1/20 0.44
MAP4K4 O95819 1/20 0.44
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42
CETP P11597 1/20 0.42
KDM5A P29375 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
KDM5B Q9UGL1 1/20 0.42
EPHX1 P07099 1/20 0.42

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
SCHEMBL374992 0.89 GLS (0.49) GLSPIM1CYP3A4CYP2D6CYP2C9
SCHEMBL375222 0.82 CARM1 (0.61) GLSPIM1CARM1PRMT6MAPK14
SCHEMBL5510189 0.81 GLS (0.44) GLSPIM1PIM2CARM1PRMT6
SCHEMBL690915 0.81 CETP (0.61) GLSPIM1CYP3A4CYP2D6CYP2C9
SCHEMBL15587388 0.76 CXCR4 (0.58) CNR2MAP4K4
SCHEMBL5518343 0.75 CARM1 (0.42) GLSCARM1PRMT6MAPK14CHRM4
SCHEMBL374836 0.75 CARM1 (0.51) GLSPIM1CARM1PRMT6EPHX1
SCHEMBL5506384 0.75 SLC6A9 (0.46) CARM1PRMT6MAPK14ROCK2ROCK1
SCHEMBL21254320 0.75 CXCR4 (0.59) MAP4K4
SCHEMBL3765787 0.75 SLC6A9 (0.51) GLSPIM1CARM1PRMT6MAPK14

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 GLS 134/4885PIM1 2564/4885CYP3A4 728/4885

“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.