SCHEMBL6457945

SCHEMBL6457945

Fc1cc(-c2nc(-c3ccccn3)n[nH]2)ccc1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.57
NPC1 O15118 4/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
ALPL P05186 1/20 0.57
PKM P14618 1/20 0.57
ALOX15 P16050 1/20 0.57
HSD17B10 Q99714 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
NOTUM Q6P988 1/20 0.49
KDM4E B2RXH2 2/20 0.48
NR1H2 P55055 4/20 0.45
NR1H3 Q13133 4/20 0.45
HPGDS O60760 1/20 0.45
DGAT1 O75907 1/20 0.45
LMNA P02545 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
TGFBR1 P36897 2/20 0.41

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
SCHEMBL6452058 0.83 NR1H2 (0.46) RAB9ANPC1SMN1; SMN2NR1H2NR1H3
SCHEMBL6450407 0.82 FEN1 (0.43) RAB9ANPC1SMN1; SMN2KDM4ENR1H2
SCHEMBL6448692 0.81 NR1H2 (0.44) RAB9ANPC1SMN1; SMN2NR1H2NR1H3
SCHEMBL6449903 0.81 NR1H2 (0.47) RAB9ANPC1SMN1; SMN2NR1H2NR1H3
SCHEMBL28714020 0.79 TOP1 (0.51) RAB9AKDM4ELMNAALDH1A1MAPK1
SCHEMBL6448397 0.79 TRPV1 (0.42) RAB9ANPC1SMN1; SMN2NR1H2NR1H3
SCHEMBL6451131 0.77 SMN1; SMN2 (0.69) RAB9ANPC1SMN1; SMN2L3MBTL1ALPL
SCHEMBL6452719 0.77 RAB9A (0.69) RAB9ANPC1SMN1; SMN2L3MBTL1ALPL
SCHEMBL4186276 0.76 SMN1; SMN2 (0.63) RAB9ANPC1SMN1; SMN2L3MBTL1ALPL
SCHEMBL6449767 0.76 SMN1; SMN2 (0.65) RAB9ANPC1SMN1; SMN2L3MBTL1ALPL

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 RAB9A 2483/4885NPC1 59/4885SMN1; SMN2 4633/4885

“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.