SCHEMBL2849991

SCHEMBL2849991

O=C([CH]COC(F)F)NCc1cccs1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.51
POLB P06746 3/20 0.50
HPGD P15428 8/20 0.49
ALDH1A1 P00352 6/20 0.49
LMNA P02545 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 3/20 0.48
TSHR P16473 1/20 0.48
USP2 O75604 1/20 0.48
RAB9A P51151 1/20 0.47
KDM4E B2RXH2 2/20 0.46
HTT P42858 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
HSD17B10 Q99714 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
SCHEMBL2851648 0.77 ALDH1A1 (0.51) HPGDALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL2849993 0.77 USP2 (0.64) RECQLPOLBHPGDALDH1A1LMNA
SCHEMBL2852748 0.76 GRM5 (0.40) HPGDLMNA
SCHEMBL20194478 0.75 POLB (0.64) RECQLPOLBHPGDALDH1A1LMNA
SCHEMBL8623265 0.73 LMNA (0.64) RECQLPOLBHPGDALDH1A1LMNA
SCHEMBL6668159 0.73 POLB (0.62) RECQLPOLBHPGDALDH1A1LMNA
SCHEMBL2858150 0.72 LMNA (0.52) HPGDALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL17152583 0.72 POLB (0.56) RECQLPOLBHPGDALDH1A1LMNA
SCHEMBL2851936 0.72 ALDH1A1 (0.47) POLBHPGDALDH1A1LMNASMN1; SMN2
SCHEMBL2856255 0.71 GAA (0.48) ALDH1A1RAB9AHTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963277-B1 FLUORINATED COMPOUNDS NPS PHARMA INC (US) 2010-01-20 EP claimed
US-20140018549-A1 USE OF D-SERINE DERIVATIVES FOR THE TREATMENT OF ANXIETY DISORDERS NPS PHARMACEUTICALS, INC. (US) 2014-01-16 US disclosed
US-7902401-B2 Fluorinated compounds NPS PHARMACEUTICALS, INC. (US) 2011-03-08 US disclosed
EP-1963277-B1 FLUORINATED COMPOUNDS NPS PHARMA INC (US) 2010-01-20 EP 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-20140018549-A1 USE OF D-SERINE DERIVATIVES FOR THE TREATMENT OF ANXIETY DISORDERS OXSR1, SRR, GLRB RECQL 1709/4885POLB 4399/4885HPGD 1422/4885

“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.