SCHEMBL2955657

SCHEMBL2955657

COc1ccc(Sc2ccc(C)cc2Nc2ccnc3nc(C)ccc23)cc1OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
AHR P35869 1/20 0.38
HTT P42858 1/20 0.38
EGFR P00533 1/20 0.38
PIM1 P11309 1/20 0.37
AKT2 P31751 1/20 0.37
MEN1 O00255 3/20 0.37
POLB P06746 2/20 0.37
MITF O75030 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
BLM P54132 1/20 0.37
HPGD P15428 2/20 0.36
IGF1R P08069 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
DHFR P00374 1/20 0.34

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 0.88 PIM1 (0.43) KMT2ALMNAHTTPIM1AKT2
SCHEMBL2968986 0.87 PIM1 (0.41) LMNAL3MBTL1EGFRPIM1AKT2
SCHEMBL2970305 0.84 PIM1 (0.38) SMN1; SMN2L3MBTL1PIM1AKT2MAPT
SCHEMBL2015588 0.83 PIM1 (0.49) KMT2APIM1AKT2MEN1MAPT
SCHEMBL2022784 0.83 PIM1 (0.39) LMNAL3MBTL1HTTEGFRPIM1
SCHEMBL2968944 0.83 PIM1 (0.39) KMT2AL3MBTL1PIM1AKT2MEN1
SCHEMBL2018796 0.83 PIM1 (0.42) KMT2ASMN1; SMN2LMNAL3MBTL1PIM1
SCHEMBL2961106 0.82 PIM1 (0.44) KMT2ASMN1; SMN2LMNAHTTPIM1
SCHEMBL2964092 0.81 PIM1 (0.42) PIM1AKT2TP53MAPTALDH1A1
SCHEMBL2961811 0.81 PIM1 (0.46) KMT2ASMN1; SMN2LMNAHTTPIM1

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 KMT2A 3566/4885SMN1; SMN2 3135/4885LMNA 3252/4885
US-20100256139-A1 Anti-Viral Compounds HAVCR2, MAVS, EIF2AK2 KMT2A 3566/4885SMN1; SMN2 3135/4885LMNA 3252/4885

“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.