SCHEMBL2858185

SCHEMBL2858185

O=[Se](c1ccccc1)C(F)F

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BBOX1 O75936 1/20 0.46
▸ EHMT2 Q96KQ7 1/20 0.46
▸ EHMT1 Q9H9B1 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
SCHEMBL7379226 0.67 — —
SCHEMBL158572 0.67 BBOX1 (0.58) BBOX1EHMT2EHMT1
SCHEMBL3142465 0.63 — —
Benzene Selenoic Acid SCHEMBL1440596 0.63 — —
SCHEMBL1165959 0.61 BBOX1 (0.50) BBOX1EHMT2EHMT1
Benzene Selenoic Acid SCHEMBL28844455 0.61 BBOX1 (0.94) BBOX1EHMT2EHMT1
Benzene Selenoic Acid SCHEMBL8752795 0.61 BBOX1 (0.94) BBOX1EHMT2EHMT1
Benzene Selenoic Acid SCHEMBL27636752 0.61 BBOX1 (0.94) BBOX1EHMT2EHMT1
Benzene Selenoic Acid SCHEMBL8752793 0.61 BBOX1 (0.50) BBOX1EHMT2EHMT1
SCHEMBL1127796 0.60 BBOX1 (0.56) BBOX1EHMT2EHMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140018549-A1 USE OF D-SERINE DERIVATIVES FOR THE TREATMENT OF ANXIETY DISORDERS NPS PHARMACEUTICALS, INC. (US) 2014-01-16 — — US disclosed
US-8450336-B2 Use of D-serine derivatives for the treatment of anxiety disorders NPS PHARMACEUTICALS, INC (US) 2013-05-28 — — US disclosed
CN-101282940-B Fluorine-containing compound NPS PHARMA INC 2013-02-13 — — CN disclosed
US-7902401-B2 Fluorinated compounds NPS PHARMACEUTICALS, INC. (US) 2011-03-08 — — US disclosed
US-20100016403-A1 USE OF D-SERINE DERIVATIVES FOR THE TREATMENT OF ANXIETY DISORDERS NPS PHARMACEUTICALS, INC. 2010-01-21 — — US disclosed
EP-1963277-B1 FLUORINATED COMPOUNDS NPS PHARMA INC (US) 2010-01-20 — — EP disclosed
EP-2099444-A1 USE OF D-SERINE DERIVATIVES FOR THE TREATMENT OF ANXIETY DISORDERS NPS PHARMACEUTICALS, INC. (CA) 2009-09-16 — — EP disclosed
US-20090005433-A1 Fluorinated Compounds NPS PHARMACEUTICALS, INC. 2009-01-01 — — US disclosed
CN-101282940-A Fluorine-containing compound NPS PHARMA INC (US) 2008-10-08 — — CN disclosed
EP-1963277-A1 FLUORINATED COMPOUNDS NPS PHARMACEUTICALS, INC. (US) 2008-09-03 — — EP disclosed
WO-2008070994-A1 USE OF D-SERINE DERIVATIVES FOR THE TREATMENT OF ANXIETY DISORDERS NPS PHARMACEUTICALS, INC. (CA) 2008-06-19 — — WO disclosed
WO-2007076306-A1 FLUORINATED COMPOUNDS NPS PHARMACEUTICALS, INC. (US) 2007-07-05 — — WO 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 (3 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-20090005433-A1 Fluorinated Compounds CNR1, NPFFR1, AFF1 BBOX1 3342/4885EHMT2 2717/4885EHMT1 2210/4885
US-20140018549-A1 USE OF D-SERINE DERIVATIVES FOR THE TREATMENT OF ANXIETY DISORDERS OXSR1, SRR, GLRB BBOX1 904/4885EHMT2 3145/4885EHMT1 2897/4885
US-20100016403-A1 USE OF D-SERINE DERIVATIVES FOR THE TREATMENT OF ANXIETY DISORDERS OXSR1, SRR, GLRB BBOX1 912/4885EHMT2 3166/4885EHMT1 2917/4885

“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.

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