SCHEMBL4654145

SCHEMBL4654145

CON=C(c1ccccc1)c1ccc2c(c1)SCC(=O)N2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ MAOB P27338 7/20 0.51
▸ MAOA P21397 6/20 0.51
▸ HTT P42858 3/20 0.50
▸ EPHX2 P34913 1/20 0.48
▸ HPGD P15428 1/20 0.46
▸ RXRA P19793 1/20 0.42
▸ RXRB P28702 1/20 0.42
▸ RXRG P48443 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.41
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL4652644 0.93 ALDH1A1 (0.62) ALDH1A1LMNAMAOBMAOAHTT
SCHEMBL4653865 0.78 HTT (0.62) ALDH1A1LMNAMAOBMAOAHTT
SCHEMBL4653945 0.77 GAA (0.45) ALDH1A1LMNARXRARXRBRXRG
SCHEMBL22226781 0.75 LMNA (0.82) ALDH1A1LMNAMAOBMAOAHTT
SCHEMBL4653850 0.75 GAA (0.56) ALDH1A1LMNAPOLBMAPTPKM
SCHEMBL3006703 0.74 HTT (0.79) ALDH1A1LMNAMAOBMAOAHTT
SCHEMBL8786021 0.73 MAOB (0.61) ALDH1A1LMNAMAOBMAOAHTT
SCHEMBL13323 0.70 ALDH1A1 (0.60) ALDH1A1LMNAMAOBMAOAHTT
SCHEMBL211460 0.70 TSHR (0.44) ALDH1A1LMNAHTTHPGDRXRA
SCHEMBL4652613 0.70 HTT (0.76) ALDH1A1LMNAMAOBMAOAHTT

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-1844029-B1 NOVEL HETEROCYCLIC OXIME DERIVATIVES, METHOD FOR PREPARING SAME AND USE THEREOF AS HYPOGLYCAEMIC OR HYPOLIPIDEMIC AGENTS SERVIER LAB (FR) 2008-11-12 — — EP disclosed
US-20080113974-A1 Heterocyclic Oxime Compounds, A Process For Their Preparation And Pharmaceutical Compositions Containing Them. LES LABORATOIRES SERVIER (FR) 2008-05-15 — — US disclosed
EP-1844029-A1 NOVEL HETEROCYCLIC OXIME DERIVATIVES, METHOD FOR PREPARING SAME AND USE THEREOF AS HYPOGLYCAEMIC OR HYPOLIPIDEMIC AGENTS Les Laboratoires Servier (FR) 2007-10-17 — — EP disclosed
WO-2006079720-A1 NOVEL HETEROCYCLIC OXIME DERIVATIVES, METHOD FOR PREPARING SAME AND USE THEREOF AS HYPOGLYCAEMIC OR HYPOLIPIDEMIC AGENTS LES LABORATOIRES SERVIER (FR) 2006-08-03 — — 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 (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-20080113974-A1 Heterocyclic Oxime Compounds, A Process For Their Preparation And Pharmaceutical Compositions Containing Them. CBR1, CYP3A7, CYP2C9 ALDH1A1 521/4885LMNA 3130/4885MAOB 26/4885

“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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