SCHEMBL2295247

SCHEMBL2295247

COc1ccccc1CC(=O)Nc1ccc2ncn(C(CC(=O)O)c3ccccc3)c2c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TSHR P16473 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 2/20 0.46
GPR55 Q9Y2T6 1/20 0.46
MAPT P10636 4/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
NOTUM Q6P988 1/20 0.44
P2RY14 Q15391 1/20 0.43
KLK7 P49862 1/20 0.42
CSNK1D P48730 1/20 0.42

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
SCHEMBL2295562 0.93 LMNA (0.48) LMNAMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL5294631 0.91 MEN1 (0.51) LMNAMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL2299138 0.88 NOTUM (0.46) LMNAMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL5305927 0.86 BCHE (0.51) LMNAMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL5289524 0.86 ITGB1 (0.44) LMNAMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL2292763 0.86 MAPT (0.50) LMNAMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2294395 0.85 MAPT (0.46) LMNAKMT2ATSHRSMN1; SMN2KDM4E
SCHEMBL2294482 0.85 NAMPT (0.48) LMNAMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL5300929 0.84 KMT2A (0.51) LMNAMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL2294905 0.84 USP2 (0.51) LMNAMEN1KMT2ASMN1; SMN2MAPT

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
US-8003806-B2 Integrin antagonists useful as anticancer agents OSI Pharmaceuticals, LLC (US) 2011-08-23 US claimed
EP-1828144-A2 INTEGRIN ANTAGONISTS USEFUL AS ANTICANCER AGENTS OSI Pharmaceuticals, Inc. (US) 2007-09-05 EP claimed
US-20060116383-A1 Integrin antagonists useful as anticancer agents ALCATEL LUCENT (FR) 2006-06-01 US claimed
WO-2006053342-A2 INTEGRIN ANTAGONISTS USEFUL AS ANTICANCER AGENTS OSI PHARMACEUTICALS, INC. (US) 2006-05-18 WO claimed

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-20060116383-A1 Integrin antagonists useful as anticancer agents ITGB5, ITGA5, ITGB1 LMNA 1740/4885MEN1 2656/4885KMT2A 3680/4885

“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.