SCHEMBL6450866

SCHEMBL6450866

Oc1ccc2ccccc2c1-c1nc(-c2ncccc2Br)n[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.38
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
NPC1 O15118 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
RAB9A P51151 2/20 0.37
ALPL P05186 1/20 0.37
PKM P14618 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
ALOX12 P18054 1/20 0.36
OPRK1 P41145 1/20 0.36

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
SCHEMBL6454319 0.85 METAP2 (0.38) POLBSMN1; SMN2NPC1L3MBTL1TDP1
SCHEMBL6454189 0.85 SMN1; SMN2 (0.39) POLBSMN1; SMN2NPC1L3MBTL1TDP1
SCHEMBL6450544 0.85 NPC1 (0.40) POLBNR1H2NR1H3SMN1; SMN2NPC1
SCHEMBL6450889 0.83 NPC1 (0.43) POLBNR1H2NR1H3SMN1; SMN2NPC1
SCHEMBL6449942 0.82 MEN1 (0.40) POLBSMN1; SMN2NPC1L3MBTL1TDP1
SCHEMBL6449769 0.81 NR1H2 (0.49) NR1H2NR1H3SMN1; SMN2NPC1L3MBTL1
SCHEMBL6449128 0.81 MAPT (0.43) POLBSMN1; SMN2NPC1L3MBTL1TDP1
SCHEMBL6450816 0.81 SMN1; SMN2 (0.40) POLBSMN1; SMN2NPC1L3MBTL1TDP1
SCHEMBL6453905 0.80 SMN1; SMN2 (0.61) POLBSMN1; SMN2NPC1L3MBTL1TDP1
SCHEMBL6449760 0.80 ADORA2A (0.57) NR1H2NR1H3SMN1; SMN2NPC1L3MBTL1

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 POLB 2806/4885NR1H2 34/4885NR1H3 24/4885

“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.