SCHEMBL2967892

SCHEMBL2967892

CCCc1ccc2c(Nc3cc(Cl)cc(OCc4ccc(Br)cc4)c3)ccnc2n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.37
MAOA P21397 4/20 0.37
GAK O14976 3/20 0.35
CCR5 P51681 1/20 0.33
SREBF2 Q12772 1/20 0.33
EPHB6 O15197 1/20 0.33
RIPK2 O43353 1/20 0.33
STK16 O75716 1/20 0.33
ABL1 P00519 1/20 0.33
ACVR1 Q04771 1/20 0.33
AAK1 Q2M2I8 1/20 0.33
COQ8A Q8NI60 1/20 0.33
NLK Q9UBE8 1/20 0.33
AR P10275 1/20 0.33
MAPT P10636 2/20 0.32
POLB P06746 1/20 0.32
THRB P10828 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL2968480 0.81 MAPT (0.41) GAKSREBF2MAPTPOLBTHRB
SCHEMBL4707575 0.81 MEN1 (0.38) MAOBMAOACCR5SREBF2MAPT
SCHEMBL2968446 0.78 PTK6 (0.54) MAOBMAOAMAPTKDM4ELMNA
SCHEMBL2954855 0.76 SREBF2 (0.42) SREBF2POLBLMNA
SCHEMBL2960109 0.76 MAPT (0.41) MAPTKDM4ELMNAL3MBTL1
SCHEMBL2965288 0.75 PIM1 (0.49) MAOBMAOASREBF2ARMAPT
SCHEMBL2971463 0.74 MAPT (0.37) MAPTPOLBKDM4E
SCHEMBL2964061 0.74 PTK6 (0.47) MAOBMAOAGAKARALK
SCHEMBL2962053 0.73 PIM1 (0.41) MAOBMAOASREBF2MAPTKDM4E
SCHEMBL2964171 0.71 PIM1 (0.45) MAOBMAOASREBF2MAPTKDM4E

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-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
US-20070232645-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 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 (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 MAOB 3352/4885MAOA 3771/4885GAK 1157/4885
US-20100256139-A1 Anti-Viral Compounds HAVCR2, MAVS, EIF2AK2 MAOB 3352/4885MAOA 3771/4885GAK 1157/4885

“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.