SCHEMBL6448692

SCHEMBL6448692

Cc1cccnc1-c1n[nH]c(-c2ccc(-c3ccccc3)c(F)c2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 5/20 0.44
NR1H3 Q13133 5/20 0.44
HPGDS O60760 1/20 0.41
DGAT1 O75907 1/20 0.41
FAAH O00519 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
FEN1 P39748 1/20 0.39
LMNA P02545 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
TOP1 P11387 1/20 0.38
SQOR Q9Y6N5 1/20 0.38
ATR Q13535 1/20 0.37
ATAD2 Q6PL18 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 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
SCHEMBL6449903 0.86 NR1H2 (0.47) NR1H2NR1H3HPGDSDGAT1SMN1; SMN2
SCHEMBL6448397 0.84 TRPV1 (0.42) NR1H2NR1H3HPGDSDGAT1SMN1; SMN2
SCHEMBL6457945 0.81 RAB9A (0.57) NR1H2NR1H3HPGDSDGAT1SMN1; SMN2
SCHEMBL6451501 0.77 SMN1; SMN2 (0.57) NR1H2NR1H3DGAT1SMN1; SMN2NPC1
SCHEMBL6452058 0.77 NR1H2 (0.46) NR1H2NR1H3HPGDSDGAT1SMN1; SMN2
SCHEMBL6451271 0.75 NR1H2 (0.61) NR1H2NR1H3TOP1
SCHEMBL6450439 0.73 TRPV1 (0.49) NR1H2NR1H3HPGDSDGAT1SMN1; SMN2
SCHEMBL6452358 0.73 MAPT (0.56) SMN1; SMN2NPC1RAB9ALMNAMEN1
SCHEMBL6448919 0.73 GRK6 (0.47) NR1H2NR1H3NPC1RAB9ASQOR
SCHEMBL6454399 0.72 IDO1 (0.41) SMN1; SMN2NPC1RAB9ASQORMEN1

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 NR1H2 34/4885NR1H3 24/4885HPGDS 398/4885

“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.