SCHEMBL2299666

SCHEMBL2299666

Cc1cccc(CC(=O)Nc2ccc3c(c2)ncn3C(CC(=O)O)c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
NR1I2 O75469 2/20 0.46
PSEN1 P49768 1/20 0.45
PSEN2 P49810 1/20 0.45
APH1B Q8WW43 1/20 0.45
NCSTN Q92542 1/20 0.45
APH1A Q96BI3 1/20 0.45
PSENEN Q9NZ42 1/20 0.45
MEN1 O00255 1/20 0.44
P2RY14 Q15391 1/20 0.43
MAPT P10636 1/20 0.43
ANO1 Q5XXA6 1/20 0.43
CACNA1G O43497 1/20 0.43
CACNA1H O95180 1/20 0.43
CACNA1I Q9P0X4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL2295665 0.93 PSEN1 (0.45) KMT2ANPC1RAB9ASMN1; SMN2PSEN1
SCHEMBL2291392 0.92 KMT2A (0.51) KMT2ANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL5305129 0.91 NPC1 (0.49) KMT2ANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL2291248 0.89 USP2 (0.51) KMT2ANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL5295744 0.86 BCHE (0.46) KMT2ANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL2295330 0.86 ALDH1A1 (0.53) KMT2ANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL2297135 0.86 KMT2A (0.46) KMT2ANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL2297533 0.85 ITGB3 (0.50) KMT2ANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL2295280 0.85 KMT2A (0.50) KMT2ANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL2291378 0.85 NPC1 (0.62) KMT2ANPC1RAB9ASMN1; SMN2LMNA

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 2 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
US-20060116383-A1 Integrin antagonists useful as anticancer agents ALCATEL LUCENT (FR) 2006-06-01 US 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 KMT2A 3680/4885NPC1 2770/4885RAB9A 1893/4885

“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.