SCHEMBL6491345

SCHEMBL6491345

Cc1ccc(C2=C(C(=O)Nc3ccc(NCCc4ccccn4)nc3)CCCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
NPC1 O15118 9/20 0.42
RAB9A P51151 9/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
TP53 P04637 4/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CTNNB1 P35222 2/20 0.41
TCF7L2 Q9NQB0 2/20 0.41
ALDH1A1 P00352 5/20 0.41
HTT P42858 2/20 0.41
ADORA3 P0DMS8 1/20 0.41
ADORA2A P29274 1/20 0.41
PKM P14618 1/20 0.40
KDR P35968 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38

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
SCHEMBL6487761 0.92 RAB9A (0.45) CYP1A2NPC1RAB9ASMN1; SMN2TP53
SCHEMBL6489289 0.90 L3MBTL1 (0.46) NPC1RAB9ASMN1; SMN2HSD17B10L3MBTL1
SCHEMBL6490864 0.89 L3MBTL1 (0.45) NPC1RAB9ASMN1; SMN2HSD17B10L3MBTL1
SCHEMBL6493547 0.89 L3MBTL1 (0.45) NPC1RAB9ASMN1; SMN2HSD17B10L3MBTL1
SCHEMBL6490871 0.89 L3MBTL1 (0.45) NPC1RAB9ASMN1; SMN2HSD17B10L3MBTL1
SCHEMBL6490251 0.89 NPC1 (0.43) CYP1A2NPC1RAB9ASMN1; SMN2TP53
SCHEMBL6487298 0.88 L3MBTL1 (0.46) NPC1RAB9ASMN1; SMN2HSD17B10L3MBTL1
SCHEMBL6491525 0.87 ALDH1A1 (0.38) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL6487835 0.84 HTR2C (0.48) NPC1RAB9ASMN1; SMN2L3MBTL1MEN1
SCHEMBL6503827 0.83 HTT (0.50) CYP1A2NPC1RAB9ASMN1; SMN2L3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 US disclosed
EP-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 CYP1A2 115/4885NPC1 100/4885RAB9A 4382/4885

“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.