SCHEMBL5066619

SCHEMBL5066619

Cc1c(C=NO)c2ccccc2n1-c1ccc(O)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.38
USP14 P54578 1/20 0.38
TSHR P16473 1/20 0.37
LMNA P02545 3/20 0.36
GAA P10253 3/20 0.36
HTT P42858 3/20 0.36
ALOX15 P16050 1/20 0.36
ALDH1A1 P00352 4/20 0.36
MAPT P10636 4/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
HPGD P15428 2/20 0.35
GFER P55789 1/20 0.35
GCGR P47871 1/20 0.35
KDM4E B2RXH2 2/20 0.34
POLB P06746 2/20 0.34
PKM P14618 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL5068717 1.00 PTGS2 (0.38) PTGS2USP14TSHRLMNAGAA
SCHEMBL5066614 1.00 PTGS2 (0.38) PTGS2USP14TSHRLMNAGAA
SCHEMBL5068704 0.88 ALDH1A1 (0.47) USP14LMNAHTTALDH1A1MEN1
SCHEMBL22310450 0.85 USP14 (0.39) USP14TSHRLMNAGAAHTT
SCHEMBL14319938 0.84 HPGD (0.36) PTGS2USP14TSHRLMNAGAA
SCHEMBL5070842 0.82 TSHR (0.42) TSHRLMNAGAAHTTALOX15
SCHEMBL5068725 0.82 TSHR (0.42) TSHRLMNAGAAHTTALOX15
SCHEMBL5068732 0.82 TSHR (0.42) TSHRLMNAGAAHTTALOX15
SCHEMBL5066622 0.80 RAB9A (0.42) LMNAGAAALDH1A1MAPTMEN1
SCHEMBL5066623 0.80 RAB9A (0.42) LMNAGAAALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1653947-B1 (4-HYDROXYPHENYL)-1H-INDOLE-3-CARBALDEHYDE OXIME DERIVATIVES AS ESTROGENIC AGENTS WYETH CORP (US) 2008-01-16 EP claimed
JP-2007502277-A 2007-02-08 JP claimed
CN-1867329-A (4-hydroxyphenyl)-1H-indole-3-carbaldehyde oxime derivative as estrogenic agents WYETH CORP (US) 2006-11-22 CN claimed
EP-1653947-A1 (4-HYDROXYPHENYL)-1H-INDOLE-3-CARBALDEHYDE OXIME DERIVATIVES AS ESTROGENIC AGENTS Wyeth Holdings Corporation (US) 2006-05-10 EP claimed
US-20050059723-A1 (Hydroxyphenyl)-1H-indole-3-carbaldehyde oxime derivatives as estrogenic agents WYETH (US) 2005-03-17 US claimed
WO-2005018636-A1 (4-HYDROXYPHENYL)-1H-INDOLE-3-CARBALDEHYDE OXIME DERIVATIVE AS ESTROGENIC AGENTS WYETH (US) 2005-03-03 WO claimed
EP-1653947-B1 (4-HYDROXYPHENYL)-1H-INDOLE-3-CARBALDEHYDE OXIME DERIVATIVES AS ESTROGENIC AGENTS WYETH CORP (US) 2008-01-16 EP disclosed
US-20070249703-A1 (Hydroxyphenyl)-1H-Indole-3-Carbaldehyde Oxime Derivatives As Estrogenic Agents WYETH (US) 2007-10-25 US disclosed
US-7250440-B2 (Hydroxyphenyl)-1H-indole-3-carbaldehyde oxime derivatives as estrogenic agents WYETH (US) 2007-07-31 US disclosed
CN-1867329-A (4-hydroxyphenyl)-1H-indole-3-carbaldehyde oxime derivative as estrogenic agents WYETH CORP (US) 2006-11-22 CN disclosed
EP-1653947-A1 (4-HYDROXYPHENYL)-1H-INDOLE-3-CARBALDEHYDE OXIME DERIVATIVES AS ESTROGENIC AGENTS Wyeth Holdings Corporation (US) 2006-05-10 EP disclosed
US-20050059723-A1 (Hydroxyphenyl)-1H-indole-3-carbaldehyde oxime derivatives as estrogenic agents WYETH (US) 2005-03-17 US disclosed
WO-2005018636-A1 (4-HYDROXYPHENYL)-1H-INDOLE-3-CARBALDEHYDE OXIME DERIVATIVE AS ESTROGENIC AGENTS WYETH (US) 2005-03-03 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 (2 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-20070249703-A1 (Hydroxyphenyl)-1H-Indole-3-Carbaldehyde Oxime Derivatives As Estrogenic Agents ESR1, ESR2, GPER1 PTGS2 533/4885USP14 2320/4885TSHR 103/4885
US-20050059723-A1 (Hydroxyphenyl)-1H-indole-3-carbaldehyde oxime derivatives as estrogenic agents ESR1, ESR2, GPER1 PTGS2 533/4885USP14 2320/4885TSHR 103/4885

“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.