SCHEMBL2969129

SCHEMBL2969129

CC(=O)Nc1ccc(Sc2ccccc2)c(Nc2ccnc3nc(C)ccc23)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.42
PIM1 P11309 1/20 0.40
AKT2 P31751 1/20 0.40
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 3/20 0.39
AURKA O14965 3/20 0.38
AURKB Q96GD4 2/20 0.38
ABL1 P00519 1/20 0.38
PDGFRB P09619 1/20 0.38
BCR P11274 1/20 0.38
PDGFRA P16234 1/20 0.38
SRC P12931 2/20 0.37
GSK3B P49841 2/20 0.37
AURKC Q9UQB9 1/20 0.37
LCK P06239 1/20 0.37
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL2968535 0.90 WNT3A (0.41) ABCG2PIM1AKT2MAPTLMNA
SCHEMBL2023477 0.89 AURKA (0.41) PIM1AKT2MAPTSMN1; SMN2KDM4E
SCHEMBL2968577 0.88 KDR (0.41) ABCG2PIM1AKT2MAPTLMNA
SCHEMBL2961826 0.87 IGF1R (0.41) PIM1AKT2MAPTAURKAAURKB
SCHEMBL2970775 0.87 AURKA (0.40) PIM1AKT2MAPTSMN1; SMN2AURKA
SCHEMBL2957055 0.86 PIM1 (0.49) PIM1AKT2MAPTLMNASMN1; SMN2
SCHEMBL2960267 0.84 BRAF (0.42) MAPTLMNAKDM4EAURKAAURKB
SCHEMBL2018796 0.84 PIM1 (0.42) ABCG2PIM1AKT2MAPTLMNA
SCHEMBL2968859 0.83 AURKA (0.40) PIM1AKT2MAPTLMNASMN1; SMN2
SCHEMBL13273825 0.83 PIM1 (0.41) ABCG2PIM1AKT2MAPTLMNA

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 7 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
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 ABCG2 956/4885PIM1 2963/4885AKT2 3903/4885
US-20100256139-A1 Anti-Viral Compounds HAVCR2, MAVS, EIF2AK2 ABCG2 956/4885PIM1 2963/4885AKT2 3903/4885

“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.