SCHEMBL2349361

SCHEMBL2349361

COc1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc1Br

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.83
▸ MEN1 O00255 5/20 0.83
▸ RAB9A P51151 11/20 0.81
▸ MAPT P10636 5/20 0.81
▸ SMN1; SMN2 Q16637 5/20 0.81
▸ NPC1 O15118 10/20 0.81
▸ POLB P06746 1/20 0.81
▸ ALOX15 P16050 1/20 0.78
▸ ALOX12 P18054 1/20 0.78
▸ NR4A1 P22736 1/20 0.78
▸ HSD17B10 Q99714 1/20 0.78
▸ LMNA P02545 1/20 0.77
▸ ALDH1A1 P00352 2/20 0.70
▸ USP2 O75604 1/20 0.66
▸ HTR1D P28221 1/20 0.64
▸ HTR1B P28222 1/20 0.64
▸ HTR2A P28223 1/20 0.64
▸ PKM P14618 1/20 0.64
▸ TP53 P04637 2/20 0.60
▸ TSHR P16473 1/20 0.60

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
SCHEMBL2346876 0.89 KMT2A (0.83) KMT2AMEN1RAB9AMAPTSMN1; SMN2
SCHEMBL13856442 0.88 MAPT (1.00) KMT2AMEN1RAB9AMAPTSMN1; SMN2
SCHEMBL12345548 0.85 NPC1 (0.83) KMT2AMEN1RAB9AMAPTSMN1; SMN2
SCHEMBL10090744 0.82 NPC1 (0.78) KMT2AMEN1RAB9AMAPTNPC1
SCHEMBL2346117 0.82 RAB9A (0.73) KMT2AMEN1RAB9AMAPTSMN1; SMN2
SCHEMBL8985995 0.82 HTR1D (0.74) KMT2AMEN1RAB9AMAPTSMN1; SMN2
SCHEMBL31254451 0.81 RAB9A (1.00) KMT2AMEN1RAB9AMAPTNPC1
SCHEMBL6293939 0.80 ROCK2 (0.65) KMT2AMEN1RAB9AMAPTSMN1; SMN2
SCHEMBL18737213 0.80 RAB9A (0.79) KMT2AMEN1RAB9AMAPTSMN1; SMN2
SCHEMBL7803371 0.78 HTR1D (1.00) KMT2AMEN1RAB9AMAPTSMN1; SMN2

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
EP-1940786-A1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C Arrow Therapeutics Limited (GB) 2008-07-09 — — EP 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 KMT2A 3804/4885MEN1 3163/4885RAB9A 1870/4885

“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.

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