SCHEMBL2964061

SCHEMBL2964061

Cc1ccc2c(Nc3cccc(OCc4ccc(Br)cc4)c3)ccnc2n1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTK6 Q13882 3/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MAOB P27338 7/20 0.44
ERBB2 P04626 1/20 0.42
MAOA P21397 3/20 0.42
F10 P00742 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
CTSV O60911 1/20 0.40
CTSL P07711 1/20 0.40
SMPD1 P17405 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
AR P10275 1/20 0.40
GAK O14976 1/20 0.40
EGFR P00533 1/20 0.40
ALK Q9UM73 1/20 0.40
APP P05067 1/20 0.40
SYK P43405 1/20 0.39

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
SCHEMBL2968446 0.78 PTK6 (0.54) PTK6MEN1KMT2AMAOBERBB2
SCHEMBL2954780 0.77 PIM1 (0.59) MEN1KMT2AMAOBMAOAAR
SCHEMBL2968512 0.75 PIM1 (0.54) MEN1KMT2AMAOBMAOA
SCHEMBL2969904 0.74 PIM1 (0.48) MEN1KMT2AMAOBMAOAAR
SCHEMBL2967892 0.74 MAOB (0.37) PTK6MAOBMAOAARGAK
SCHEMBL2969836 0.73 PIM1 (0.55) MEN1KMT2AMAOBMAOAAR
SCHEMBL810367 0.73 EGFR (0.57) MAOBEGFR
SCHEMBL2960109 0.72 MAPT (0.41) MEN1KMT2A
SCHEMBL19633519 0.72 GAK (0.57) PTK6MAOBERBB2PIK3CBPIK3CG
SCHEMBL2971463 0.72 MAPT (0.37) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338605-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2012-12-25 US disclosed
US-20100256139-A1 Anti-Viral Compounds ABBOTT LABORATORIES (US) 2010-10-07 US disclosed
EP-1979349-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2010-07-28 EP disclosed
US-7763731-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2010-07-27 US disclosed
CN-101384592-A Antiviral compounds ABBOTT LAB (US) 2009-03-11 CN disclosed
EP-1979349-A2 ANTI-VIRAL COMPOUNDS Abbott Laboratories (US) 2008-10-15 EP disclosed
US-20070232645-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 US disclosed
WO-2007076035-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2007-07-05 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 (2 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-20070232645-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 PTK6 3229/4885MEN1 4571/4885KMT2A 3566/4885
US-20100256139-A1 Anti-Viral Compounds HAVCR2, MAVS, EIF2AK2 PTK6 3229/4885MEN1 4571/4885KMT2A 3566/4885

“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.