SCHEMBL5353452

SCHEMBL5353452

COc1cc2c(=O)c(-c3nc(Cc4ccccc4)no3)cn(CC3CCCCC3)c2cc1OC

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
NMT1 P30419 9/20 0.44
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL5361237 0.82 ALDH1A1 (0.52) SMN1; SMN2LMNANMT1MAPTNPSR1
SCHEMBL5470492 0.76 USP10 (0.46) SMN1; SMN2MAPTMAPK1
SCHEMBL5466315 0.74 LMNA (0.44) SMN1; SMN2LMNACNR1CNR2MAPT
SCHEMBL5327097 0.72 PDE10A (0.49) SMN1; SMN2CNR1CNR2MAPTMAPK1
SCHEMBL5355725 0.69 PDE4A (0.42) SMN1; SMN2CNR1CNR2NPC1RAB9A
SCHEMBL5356153 0.68 TP53 (0.44) SMN1; SMN2LMNACNR1CNR2MAPT
SCHEMBL5459372 0.67 ALDH1A1 (0.43) SMN1; SMN2LMNANPC1
SCHEMBL5353454 0.67 KMT2A (0.52) SMN1; SMN2LMNAMAPTNPSR1MAPK1
SCHEMBL5370074 0.67 TP53 (0.45) SMN1; SMN2LMNACNR1CNR2MAPT
SCHEMBL5777096 0.63 NPC1 (0.46) SMN1; SMN2CNR1CNR2NPC1MAPK1

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-20070287699-A1 ANTIVIRAL AGENTS VIROBAY, INC. (US) 2007-12-13 US disclosed
US-20070287699-A1 ANTIVIRAL AGENTS VIROBAY, INC. (US) 2007-12-13 US disclosed
US-20070287699-A1 ANTIVIRAL AGENTS VIROBAY, INC. (US) 2007-12-13 US disclosed
WO-2007130499-A2 ANTIVIRAL AGENTS VIROBAY, INC. (US) 2007-11-15 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-20070287699-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 SMN1; SMN2 2454/4885LMNA 4460/4885NMT1 1028/4885

“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.