SCHEMBL6449935

SCHEMBL6449935

Oc1ccc2ccccc2c1-c1nnc(-c2ncc(C(F)(F)F)cc2Cl)o1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.44
RAB9A P51151 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
NPC1 O15118 3/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 9/20 0.40
KDM4E B2RXH2 6/20 0.40
POLB P06746 4/20 0.40
NPSR1 Q6W5P4 2/20 0.40
LMNA P02545 2/20 0.40
RXFP1 Q9HBX9 1/20 0.39
MERTK Q12866 1/20 0.39
MAPT P10636 3/20 0.39
HTT P42858 2/20 0.39
GLA P06280 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ATR Q13535 1/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL6448377 0.80 ALDH1A1 (0.57) HPGDRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL28500366 0.77 ALDH1A1 (0.55) HPGDRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL6448391 0.76 MEN1 (0.40) HPGDRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL6451368 0.75 MAPT (0.45) HPGDRAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL28501254 0.74 ALDH1A1 (0.52) HPGDRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL6452385 0.74 ALDH1A1 (0.52) HPGDRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL28488632 0.73 ALDH1A1 (0.54) HPGDRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL28504949 0.73 ALDH1A1 (0.54) HPGDRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL28492972 0.73 ALDH1A1 (0.51) HPGDRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL28502373 0.73 ALDH1A1 (0.51) HPGDRAB9ASMN1; SMN2NPC1MAPK1

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 HPGD 258/4885RAB9A 2483/4885SMN1; 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.