SCHEMBL2291248

SCHEMBL2291248

COc1cccc(CC(=O)Nc2ccc3c(c2)ncn3C(CC(=O)O)c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.51
NTSR1 P30989 1/20 0.47
MAPT P10636 3/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
KDM6B O15054 1/20 0.46
KDM5A P29375 1/20 0.46
KDM4D Q6B0I6 1/20 0.46
KDM4C Q9H3R0 1/20 0.46
KDM5B Q9UGL1 1/20 0.46
KDM2A Q9Y2K7 1/20 0.46
KDM3A Q9Y4C1 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HPGD P15428 1/20 0.46
P2RY14 Q15391 1/20 0.45
PDGFRB P09619 2/20 0.44
FLT4 P35916 2/20 0.44
CSF1R P07333 1/20 0.44
FLT3 P36888 1/20 0.44
RAB9A P51151 2/20 0.44

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
SCHEMBL2294905 0.93 USP2 (0.51) USP2NTSR1MAPTKMT2AMEN1
SCHEMBL2297605 0.91 SMN1; SMN2 (0.52) USP2MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2291392 0.89 KMT2A (0.51) KMT2AMEN1SMN1; SMN2HPGDRAB9A
SCHEMBL2299666 0.89 KMT2A (0.48) MAPTKMT2AMEN1SMN1; SMN2P2RY14
SCHEMBL5303427 0.86 BCHE (0.51) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL5307759 0.86 KDR (0.44) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL5300929 0.86 KMT2A (0.51) MAPTKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL2295330 0.85 ALDH1A1 (0.53) MAPTKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5305129 0.85 NPC1 (0.49) MAPTKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL2292763 0.84 MAPT (0.50) USP2MAPTKMT2AMEN1SMN1; SMN2

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 USP2 4626/4885NTSR1 3089/4885MAPT 4745/4885

“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.