SCHEMBL6449112

SCHEMBL6449112

Cc1ccccc1C(=O)NNC(=O)c1ncc(Cl)cc1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.49
HTT P42858 2/20 0.49
RAB9A P51151 2/20 0.49
ALOX15 P16050 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPT P10636 2/20 0.44
KDM4E B2RXH2 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
POLB P06746 3/20 0.43
ALOX12 P18054 1/20 0.43
RXFP1 Q9HBX9 1/20 0.41
KCNMA1 Q12791 1/20 0.41
GAA P10253 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL6461094 0.87 SMN1; SMN2 (0.51) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL6470094 0.85 LMNA (0.53) NPC1RAB9AALDH1A1LMNASMN1; SMN2
SCHEMBL6452299 0.80 L3MBTL1 (0.51) NPC1RAB9AL3MBTL1ALDH1A1LMNA
SCHEMBL6449862 0.76 GAA (0.62) NPC1RAB9AL3MBTL1ALDH1A1LMNA
SCHEMBL2650229 0.71 POLB (0.72) NPC1RAB9AL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL3128646 0.70 ASPH (0.45) HTTRAB9AL3MBTL1ALDH1A1LMNA
SCHEMBL12347487 0.70 CYP2C9 (0.41) NPC1HTTRAB9AALOX15ALDH1A1
SCHEMBL12492025 0.69 NPC1 (0.42) NPC1HTTRAB9ASMN1; SMN2MEN1
SCHEMBL30401147 0.69 ALDH1A1 (0.42) HTTRAB9AL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL11822574 0.68 POLB (0.78) NPC1HTTRAB9AL3MBTL1ALDH1A1

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 1 patent. 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

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 NPC1 59/4885HTT 1540/4885RAB9A 2483/4885

“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.