SCHEMBL6448592

SCHEMBL6448592

c1ccc(-c2n[nH]c(-c3cccc4ccccc34)n2)nc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.67
NPC1 O15118 5/20 0.67
TDP1 Q9NUW8 5/20 0.67
RAB9A P51151 4/20 0.67
L3MBTL1 Q9Y468 4/20 0.67
ALOX15 P16050 3/20 0.67
HSD17B10 Q99714 2/20 0.67
ALPL P05186 2/20 0.67
PKM P14618 1/20 0.67
KDM4E B2RXH2 9/20 0.56
TP53 P04637 5/20 0.56
ALDH1A1 P00352 2/20 0.56
MAPT P10636 2/20 0.56
HPGD P15428 2/20 0.56
MAPK1 P28482 2/20 0.56
TGFBR1 P36897 1/20 0.46
NOTUM Q6P988 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL6451992 0.81 KDM4E (0.53) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1
SCHEMBL8311588 0.81 SMN1; SMN2 (1.00) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1
SCHEMBL6451131 0.81 SMN1; SMN2 (0.69) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1
SCHEMBL6448976 0.81 SMN1; SMN2 (0.69) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1
SCHEMBL5959950 0.81 SMN1; SMN2 (0.69) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1
SCHEMBL6451923 0.81 SMN1; SMN2 (0.69) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1
SCHEMBL6450871 0.79 BCHE (0.46) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1
SCHEMBL6453905 0.79 SMN1; SMN2 (0.61) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1
SCHEMBL17279723 0.78 NR1H2 (0.64) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1
SCHEMBL6450074 0.78 KDM4E (0.47) SMN1; SMN2NPC1TDP1RAB9AL3MBTL1

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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus ANADYS PHARMACEUTICALS, INC. (US) 2005-04-07 US disclosed
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus HAVCR2, HCCS, LIPC SMN1; SMN2 4633/4885NPC1 59/4885TDP1 4550/4885

“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.