SCHEMBL6450144

SCHEMBL6450144

Oc1ccc(Cl)cc1-c1nc(-c2nccc3ccccc23)n[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.44
ADORA2A P29274 1/20 0.44
MEN1 O00255 3/20 0.40
MAPT P10636 3/20 0.40
HPGD P15428 3/20 0.40
KMT2A Q03164 3/20 0.40
PIM1 P11309 1/20 0.40
LMNA P02545 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
DCUN1D1 Q96GG9 1/20 0.39
CYP19A1 P11511 1/20 0.39
NPY5R Q15761 1/20 0.38
HTR1A P08908 1/20 0.38
HTR2A P28223 1/20 0.38
HTR7 P34969 1/20 0.38
HTR6 P50406 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL6449802 0.88 GUSB (0.43) ADORA2AMAPTKMT2AALOX15MAPK1
SCHEMBL6459671 0.88 ADORA2A (0.57) IDO1ADORA2AMEN1MAPTHPGD
SCHEMBL6457130 0.86 GRK6 (0.43) IDO1ADORA2AMEN1MAPTHPGD
SCHEMBL6450301 0.86 GRK6 (0.43) IDO1ADORA2AMEN1MAPTHPGD
SCHEMBL6451195 0.86 ADORA2A (0.41) IDO1ADORA2AMAPTKMT2AMAPK1
SCHEMBL6450636 0.83 GUSB (0.48) ADORA2AMEN1MAPTHPGDKMT2A
SCHEMBL6451504 0.83 ADORA2A (0.39) ADORA2AMEN1MAPTHPGDKMT2A
SCHEMBL6449907 0.81 GRK6 (0.48) ADORA2AMEN1MAPTHPGDKMT2A
SCHEMBL6450544 0.80 NPC1 (0.40) ADORA2AMAPTHPGDKMT2ALMNA
SCHEMBL6454663 0.80 IDO1 (0.45) IDO1ADORA2AMEN1MAPTHPGD

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 IDO1 2394/4885ADORA2A 1442/4885MEN1 3473/4885

“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.