SCHEMBL2299138

SCHEMBL2299138

Cc1ccccc1CC(=O)Nc1ccc2ncn(C(CC(=O)O)c3ccccc3)c2c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NR1I2 O75469 2/20 0.43
ANO1 Q5XXA6 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 1/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
AKR1B1 P15121 1/20 0.42
LMNA P02545 1/20 0.41
P2RY14 Q15391 1/20 0.41
ITGB1 P05556 2/20 0.41
ITGA4 P13612 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ASAH1 Q13510 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL2295280 0.93 KMT2A (0.50) NOTUMMEN1KMT2ANR1I2ANO1
SCHEMBL2295247 0.88 LMNA (0.50) NOTUMMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL2294482 0.87 NAMPT (0.48) MEN1KMT2ANR1I2SMN1; SMN2NPC1
SCHEMBL5289381 0.87 ITGB1 (0.44) NOTUMSMN1; SMN2NPC1RAB9AITGB1
SCHEMBL2295180 0.85 SMN1; SMN2 (0.47) MEN1KMT2ANR1I2SMN1; SMN2HTT
SCHEMBL2295665 0.85 PSEN1 (0.45) NOTUMMEN1KMT2AANO1SMN1; SMN2
SCHEMBL2294562 0.85 MAPT (0.44) MEN1KMT2ANR1I2SMN1; SMN2HTT
SCHEMBL2297504 0.85 FFAR1 (0.48) NOTUMMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2298594 0.84 KMT2A (0.46) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL2295362 0.83 SMN1; SMN2 (0.43) NOTUMMEN1KMT2ASMN1; SMN2HTT

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 NOTUM 4828/4885MEN1 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.