SCHEMBL6448545

SCHEMBL6448545

FC(F)(F)c1cccnc1-c1n[nH]c(-c2c(Cl)cccc2Cl)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.53
SCN5A Q14524 3/20 0.43
SCN9A Q15858 3/20 0.43
TRPV1 Q8NER1 8/20 0.38
NOTUM Q6P988 1/20 0.37
NPC1 O15118 2/20 0.37
ALPL P05186 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
PKM P14618 1/20 0.36
ALOX15 P16050 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
SCHEMBL6454404 0.79 KDR (0.39) TRPV1NPC1ALPLRAB9ASMN1; SMN2
SCHEMBL6449942 0.78 MEN1 (0.40) SCN5ASCN9ATRPV1NPC1ALPL
SCHEMBL6453884 0.78 TRPV1 (0.44) TRPV1NOTUMNPC1RAB9ASMN1; SMN2
SCHEMBL6454148 0.78 SMN1; SMN2 (0.53) SCN5ASCN9ATRPV1NPC1RAB9A
SCHEMBL6454218 0.77 IDO1 (0.42) TRPV1SMN1; SMN2HPGDALOX15
SCHEMBL6450021 0.77 ADORA2A (0.53) TRPV1NPC1ALPLRAB9ASMN1; SMN2
SCHEMBL6453583 0.77 JAK2 (0.58) JAK2TRPV1NPC1ALPLRAB9A
SCHEMBL6448731 0.75 NR1H2 (0.56) TRPV1NR1H2NR1H3
SCHEMBL6451042 0.74 GRK6 (0.40) TRPV1KDR
SCHEMBL5959907 0.73 SMN1; SMN2 (0.69) JAK2NOTUMNPC1ALPLRAB9A

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 JAK2 524/4885SCN5A 4270/4885SCN9A 4771/4885

“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.