SCHEMBL6449564

SCHEMBL6449564

Cc1cccnc1-c1noc(-c2cc(OCCc3ccccc3)ccc2O)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.40
MAOB P27338 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
USP2 O75604 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 2/20 0.38
GAA P10253 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MITF O75030 1/20 0.38
PKM P14618 1/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38
SLC16A3 O15427 1/20 0.37
ACHE P22303 1/20 0.37
CYP11B1 P15538 1/20 0.37

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
SCHEMBL6451387 0.88 ACACB (0.43) L3MBTL1HTTRAB9ANPC1GAA
SCHEMBL6451861 0.86 TP53 (0.49) L3MBTL1RAB9ANPC1GAASMN1; SMN2
SCHEMBL6448686 0.84 CYP3A4 (0.44) MAOAMAOBL3MBTL1RAB9ANPC1
SCHEMBL6452158 0.83 CYP19A1 (0.46) L3MBTL1ALOX15HTTRAB9AMEN1
SCHEMBL6449934 0.81 ACACB (0.42) L3MBTL1TSHRHTTRAB9AMEN1
SCHEMBL6453543 0.79 NPC1 (0.46) L3MBTL1USP2ALOX15TSHRRAB9A
SCHEMBL6452697 0.79 NPC1 (0.45) L3MBTL1USP2TSHRRAB9AMEN1
SCHEMBL6448952 0.78 TP53 (0.50) L3MBTL1USP2ALOX15HTTRAB9A
SCHEMBL6452535 0.77 CASP3 (0.60) L3MBTL1USP2ALOX15TSHRRAB9A
SCHEMBL6448675 0.77 NR1H4 (0.48) L3MBTL1TSHRHTTRAB9AMEN1

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 MAOA 1617/4885MAOB 1228/4885L3MBTL1 4366/4885

“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.