SCHEMBL12459047

SCHEMBL12459047

Cc1ccc(NC(=O)C2CC2)cc1-c1ccc(NC(=O)c2ccc(CN3CCS(=O)(=O)CC3)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.65
▸ RAB9A P51151 2/20 0.65
▸ NPC1 O15118 1/20 0.65
▸ ABL1 P00519 7/20 0.64
▸ KDM4E B2RXH2 1/20 0.58
▸ MAPT P10636 1/20 0.58
▸ MAPK14 Q16539 6/20 0.58
▸ PKM P14618 1/20 0.57
▸ LCK P06239 4/20 0.55
▸ CSF1R P07333 4/20 0.55
▸ EGFR P00533 1/20 0.54
▸ KDR P35968 1/20 0.54
▸ ERBB4 Q15303 1/20 0.54

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
SCHEMBL2347964 0.91 ABL1 (0.65) ALDH1A1RAB9ANPC1ABL1MAPK14
SCHEMBL2352219 0.90 ABL1 (0.64) ABL1MAPK14LCKCSF1REGFR
SCHEMBL14344755 0.90 ALDH1A1 (0.66) ALDH1A1RAB9ANPC1ABL1KDM4E
SCHEMBL12394254 0.89 PKM (0.62) ALDH1A1RAB9ANPC1ABL1KDM4E
SCHEMBL14344806 0.88 ABL1 (0.62) ABL1MAPK14LCKCSF1REGFR
SCHEMBL2346102 0.87 MAPK14 (0.65) ABL1MAPK14LCKCSF1REGFR
SCHEMBL12394317 0.87 MAPK14 (0.58) ALDH1A1RAB9ANPC1ABL1KDM4E
SCHEMBL12394275 0.87 RAB9A (0.72) ALDH1A1RAB9ANPC1ABL1KDM4E
SCHEMBL14028049 0.87 ALDH1A1 (0.72) ALDH1A1RAB9ANPC1ABL1KDM4E
SCHEMBL3919974 0.87 ABL1 (0.63) ALDH1A1RAB9ANPC1ABL1MAPK14

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8008303-B2 e.g. 6-Methyl-biphenyl-3,4'-dicarboxylic acid 4'-[(3-bromo-phenyl)-amide]-[(4 morpholin-4-yl-phenyl)-amide]; viricide; with other active viricide such as interferon or ribavirin ASTRAZENECA AB (SE) 2011-08-30 — — US disclosed
EP-1940786-B1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C ARROW THERAPEUTICS LTD (GB) 2010-08-18 — — EP disclosed
US-20080255105-A1 Biphenyl Derivatives and Their Use in Treating Hepatitis C ARROW THERAPEUTICS LIMITED (GB) 2008-10-16 — — US disclosed
US-20080255105-A1 Biphenyl Derivatives and Their Use in Treating Hepatitis C ARROW THERAPEUTICS LIMITED (GB) 2008-10-16 — — US disclosed
WO-2007031791-A1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C ARROW THERAPEUTICS LIMITED (GB) 2007-03-22 — — 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-20080255105-A1 Biphenyl Derivatives and Their Use in Treating Hepatitis C NR4A1, NR0B1, NR1H4 ALDH1A1 441/4885RAB9A 1870/4885NPC1 146/4885

“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.

Send feedback