SCHEMBL403600

SCHEMBL403600

CCOc1ccc(C(=O)Nc2cc(C)ccn2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 1.00
RAB9A P51151 11/20 1.00
PKM P14618 4/20 1.00
SMN1; SMN2 Q16637 3/20 1.00
LMNA P02545 3/20 0.73
CHRNB2 P17787 1/20 0.70
CHRNB4 P30926 1/20 0.70
CHRNA3 P32297 1/20 0.70
CHRNA4 P43681 1/20 0.70
L3MBTL1 Q9Y468 1/20 0.65
TP53 P04637 3/20 0.64
ALDH1A1 P00352 3/20 0.64
TDP1 Q9NUW8 1/20 0.62
MAPT P10636 2/20 0.62
KDM4E B2RXH2 1/20 0.62
MITF O75030 1/20 0.62
XBP1 P17861 1/20 0.62
HTT P42858 1/20 0.62
KMT2A Q03164 2/20 0.61
MEN1 O00255 1/20 0.61

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
SCHEMBL29083758 0.85 NPC1 (0.74) NPC1RAB9APKMSMN1; SMN2LMNA
SCHEMBL16604283 0.84 NPC1 (0.76) NPC1RAB9APKMSMN1; SMN2LMNA
SCHEMBL17675306 0.81 NPC1 (0.72) NPC1RAB9APKMSMN1; SMN2LMNA
SCHEMBL16594545 0.80 NPC1 (0.70) NPC1RAB9APKMSMN1; SMN2LMNA
SCHEMBL21349103 0.80 NPC1 (0.70) NPC1RAB9APKMSMN1; SMN2LMNA
SCHEMBL26293792 0.80 NPC1 (0.70) NPC1RAB9APKMSMN1; SMN2LMNA
SCHEMBL17065565 0.80 NPC1 (0.89) NPC1RAB9APKMSMN1; SMN2LMNA
SCHEMBL2176413 0.80 NPC1 (0.89) NPC1RAB9APKMSMN1; SMN2LMNA
SCHEMBL7900640 0.79 NPC1 (0.68) NPC1RAB9APKMSMN1; SMN2LMNA
SCHEMBL14082359 0.78 NPC1 (0.71) NPC1RAB9APKMSMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150105433-A1 TREATING VIRAL INFECTIONS HAVING VIRAL RNAs TRANSLATED BY A NON-IRES MEDIATED MECHANISM THE UAB RESEARCH FOUNDATION 2015-04-16 US disclosed
US-20150105433-A1 TREATING VIRAL INFECTIONS HAVING VIRAL RNAs TRANSLATED BY A NON-IRES MEDIATED MECHANISM THE UAB RESEARCH FOUNDATION 2015-04-16 US disclosed
US-20120065247-A1 MODULATING IRES-MEDIATED TRANSLATION DISCOVERYBIOMED, INC. (US) 2012-03-15 US disclosed
US-20120065247-A1 MODULATING IRES-MEDIATED TRANSLATION DISCOVERYBIOMED, INC. (US) 2012-03-15 US disclosed
WO-2010111653-A2 MODULATING IRES-MEDIATED TRANSLATION THE UAB RESEARCH FOUNDATION (US) 2010-09-30 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 (2 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-20120065247-A1 MODULATING IRES-MEDIATED TRANSLATION EIF2AK2, EIF4EBP1, EIF4E NPC1 2519/4885RAB9A 2106/4885PKM 3436/4885
US-20150105433-A1 TREATING VIRAL INFECTIONS HAVING VIRAL RNAs TRANSLATED BY A NON-IRES MEDIATED MECHANISM EIF2AK2, RPS25, RPL35 NPC1 859/4885RAB9A 2752/4885PKM 2348/4885

“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.