SCHEMBL2074470

SCHEMBL2074470

COC(=O)c1cc2c([nH]1)CCC2=Cc1ccc(F)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALPL P05186 2/20 0.38
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
CASP3 P42574 1/20 0.37
KMT2A Q03164 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
PAK1 Q13153 2/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33

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
SCHEMBL2074468 1.00 ALPL (0.38) ALPLMAPTMEN1CASP3KMT2A
SCHEMBL2074466 1.00 ALPL (0.38) ALPLMAPTMEN1CASP3KMT2A
SCHEMBL2076158 0.90 MAOA (0.42) ALPLMAPTMEN1KMT2AMAOA
SCHEMBL2076160 0.90 MAOA (0.42) ALPLMAPTMEN1KMT2AMAOA
SCHEMBL2076165 0.90 MAOA (0.42) ALPLMAPTMEN1KMT2AMAOA
SCHEMBL1004165 0.88 EGFR (0.40) ALPLMAPTMEN1KMT2AALDH1A1
SCHEMBL1004163 0.88 EGFR (0.40) ALPLMAPTMEN1KMT2AALDH1A1
SCHEMBL1081767 0.85 HSD11B1 (0.42) ALPLMAPTMEN1KMT2AALDH1A1
SCHEMBL1081766 0.85 HSD11B1 (0.42) ALPLMAPTMEN1KMT2AALDH1A1
SCHEMBL1004727 0.83 SERPINH1 (0.36) ALPLMAPTMEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902252-B2 Inhibitors of D-amino acid oxidase SEPRACOR, INC. (US) 2011-03-08 US disclosed
US-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-04 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-20100029737-A1 INHIBITORS OF D-AMINO ACID OXIDASE DDO, DAO, ACHE ALPL 835/4885MAPT 444/4885MEN1 4856/4885

“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.