SCHEMBL3446215

SCHEMBL3446215

CC(Cl)C(=O)Nc1ccc2[nH]c(=O)oc2c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 1/20 0.50
▸ NOS1 P29475 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ GRIN2D O15399 2/20 0.46
▸ GRIN3B O60391 2/20 0.46
▸ GRIN1 Q05586 2/20 0.46
▸ GRIN2A Q12879 2/20 0.46
▸ GRIN2B Q13224 2/20 0.46
▸ GRIN2C Q14957 2/20 0.46
▸ GRIN3A Q8TCU5 2/20 0.46
▸ MAPKAPK2 P49137 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ TDP1 Q9NUW8 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
SCHEMBL9678808 0.81 CREBBP (0.56) CREBBPNOS1KDM4EALDH1A1GRIN2D
SCHEMBL23252425 0.81 CREBBP (0.45) CREBBPNOS1KDM4EALDH1A1GRIN2D
SCHEMBL21460047 0.80 NOS1 (0.56) CREBBPNOS1KDM4EALDH1A1GRIN2D
SCHEMBL31129257 0.79 CREBBP (0.61) CREBBPNOS1KDM4EALDH1A1GRIN2D
SCHEMBL24430175 0.79 CREBBP (0.52) CREBBPNOS1KDM4EALDH1A1GRIN2D
SCHEMBL4578890 0.78 KDM4E (0.59) KDM4EALDH1A1MAPKAPK2
SCHEMBL23252492 0.78 CREBBP (0.44) CREBBPNOS1GRIN2DGRIN3BGRIN1
SCHEMBL4576717 0.77 GRIN2D (0.55) CREBBPNOS1GRIN2DGRIN3BGRIN1
SCHEMBL22425024 0.77 NOS1 (0.60) CREBBPNOS1MAPKAPK2POLBTDP1
SCHEMBL2590587 0.76 CREBBP (0.61) CREBBPNOS1KDM4EALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816376-B2 Cyclic amides MERCK PATENT GMBH (DE) 2010-10-19 — — US disclosed
EP-1485363-B1 CYCLIC AMIDES MERCK PATENT GMBH (DE) 2008-10-08 — — EP disclosed
US-20050124627-A1 Cyclic amides MERCK PATENT GMBH (DE) 2005-06-09 — — US disclosed
EP-1485363-A1 CYCLIC AMIDES MERCK PATENT GmbH (DE) 2004-12-15 — — EP disclosed
WO-2003076420-A1 CYCLIC AMIDES MERCK PATENT GMBH (DE) 2003-09-18 — — 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-20050124627-A1 Cyclic amides NPY1R, GRIK1, GRIK4 CREBBP 1702/4885NOS1 2666/4885KDM4E 578/4885

“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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