SCHEMBL15919130

SCHEMBL15919130

Cc1ccc2c(Nc3cc(N(C)C)ccc3Sc3ccc(N)cc3)ccnc2n1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.37
AKT2 P31751 1/20 0.37
EGFR P00533 1/20 0.31
ADK P55263 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
PLK4 O00444 1/20 0.31

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
SCHEMBL13274111 0.88 PIM1 (0.36) PIM1AKT2
SCHEMBL2022784 0.88 PIM1 (0.39) PIM1AKT2EGFRADORA2AADORA1
SCHEMBL15290720 0.85 PIM1 (0.38) PIM1AKT2PLK4
SCHEMBL13274115 0.82 NPC1 (0.36) PIM1AKT2ADORA2AADORA1
SCHEMBL2968986 0.81 PIM1 (0.41) PIM1AKT2EGFRADORA2AADORA1
SCHEMBL2961780 0.80 PIM1 (0.39) PIM1AKT2EGFRADORA2AADORA1
SCHEMBL13274112 0.79 SREBF2 (0.44) PIM1AKT2
SCHEMBL13274110 0.79 PIM1 (0.34) PIM1AKT2
SCHEMBL13274108 0.79 MEN1 (0.35) PIM1AKT2
SCHEMBL13330161 0.77 PIM1 (0.49) PIM1AKT2ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9249138-B2 Anti-viral compounds ABBVIE INC. (US) 2016-02-02 US disclosed
US-20140213595-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. (US) 2014-07-31 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 (1 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-20140213595-A1 ANTI-VIRAL COMPOUNDS HAVCR2, EIF2AK2, MAVS PIM1 2836/4885AKT2 2913/4885EGFR 3726/4885

“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.