SCHEMBL6460671

SCHEMBL6460671

COc1cccc(-c2nc(-c3ccc(C(F)(F)F)cn3)n[nH]2)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
TSHR P16473 1/20 0.43
TDO2 P48775 2/20 0.43
IDO1 P14902 1/20 0.43
KDM4E B2RXH2 2/20 0.41
PKM P14618 1/20 0.41
GUSB P08236 1/20 0.39
MAP4K1 Q92918 1/20 0.39
F2 P00734 1/20 0.38
F10 P00742 1/20 0.38
PLG P00747 1/20 0.38
PLAU P00749 1/20 0.38
PLAT P00750 1/20 0.38
PRSS1 P07477 1/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
KMT2A Q03164 4/20 0.37
MAPT P10636 4/20 0.37
MEN1 O00255 3/20 0.37
HTT P42858 2/20 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
SCHEMBL6448407 0.90 HPGD (0.43) SMN1; SMN2TSHRKDM4EF2F10
SCHEMBL6450106 0.81 ADORA2A (0.53) SMN1; SMN2IDO1KDM4EPKMALDH1A1
SCHEMBL6460680 0.80 NPC1 (0.56) SMN1; SMN2KDM4EPKMGUSBF2
SCHEMBL6449821 0.80 MAPT (0.44) SMN1; SMN2KDM4EALDH1A1GAAKMT2A
SCHEMBL6452660 0.79 GRK6 (0.45) SMN1; SMN2TSHRTDO2IDO1KDM4E
SCHEMBL6448859 0.79 GRK6 (0.44) SMN1; SMN2TSHRTDO2IDO1GAA
SCHEMBL6458879 0.78 KDM4E (0.44) SMN1; SMN2KDM4EPKMGUSBF2
SCHEMBL6459405 0.78 NPC1 (0.40) SMN1; SMN2IDO1KDM4EPKMALDH1A1
SCHEMBL6454417 0.77 KDM4E (0.50) SMN1; SMN2KDM4EPKMGUSBF2
SCHEMBL6450295 0.77 KDM4E (0.41) KDM4EPKMGUSBF2F10

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 4633/4885TSHR 4398/4885TDO2 4257/4885

“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.