SCHEMBL2964092

SCHEMBL2964092

Cc1ccc(Sc2ccc(OC(C)C)cc2)c(Nc2ccnc3nc(C)ccc23)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.42
AKT2 P31751 1/20 0.42
PTGIR P43119 1/20 0.34
TGFBR1 P36897 1/20 0.33
DHODH Q02127 1/20 0.30
MAPT P10636 2/20 0.30
TP53 P04637 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
FDPS P14324 1/20 0.30

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
SCHEMBL2962035 0.89 PIM1 (0.43) PIM1AKT2PTGIRTGFBR1MAPT
SCHEMBL2968986 0.89 PIM1 (0.41) PIM1AKT2MAPTTP53ALDH1A1
SCHEMBL2961106 0.87 PIM1 (0.44) PIM1AKT2PTGIRMAPTTP53
SCHEMBL2961811 0.86 PIM1 (0.46) PIM1AKT2PTGIRMAPTTP53
SCHEMBL2969084 0.86 PIM1 (0.39) PIM1AKT2
SCHEMBL2970313 0.85 PIM1 (0.45) PIM1AKT2MAPTALDH1A1GAA
SCHEMBL2015588 0.85 PIM1 (0.49) PIM1AKT2MAPTGAA
SCHEMBL2968944 0.85 PIM1 (0.39) PIM1AKT2TGFBR1MAPTTP53
SCHEMBL2022784 0.85 PIM1 (0.39) PIM1AKT2MAPTALDH1A1GAA
SCHEMBL2957118 0.85 PIM1 (0.41) PIM1AKT2ALDH1A1GAA

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 PIM1 2963/4885AKT2 3903/4885PTGIR 3658/4885
US-20100256139-A1 Anti-Viral Compounds HAVCR2, MAVS, EIF2AK2 PIM1 2963/4885AKT2 3903/4885PTGIR 3658/4885

“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.