SCHEMBL15601780

SCHEMBL15601780

Cc1c(C(N)=O)ncn1C(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MEN1 O00255 1/20 0.37
PABPC1 P11940 1/20 0.37
KMT2A Q03164 1/20 0.37
HCAR3 P49019 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
ADORA2A P29274 4/20 0.36
ADORA1 P30542 4/20 0.36
ADORA2B P29275 2/20 0.35
PI4KA P42356 1/20 0.35
PI4K2B Q8TCG2 1/20 0.35
PI4K2A Q9BTU6 1/20 0.35
PI4KB Q9UBF8 1/20 0.35
CDK1 P06493 2/20 0.35
CCNB1 P14635 2/20 0.35
CCNE1 P24864 2/20 0.35
CDK2 P24941 2/20 0.35
TGFBR1 P36897 2/20 0.34
TGFBR2 P37173 2/20 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
SCHEMBL18050898 0.81 ALDH1A1 (0.42) LMNAALDH1A1MEN1PABPC1KMT2A
SCHEMBL6691811 0.81 ALDH1A1 (0.54) LMNAALDH1A1MEN1PABPC1KMT2A
SCHEMBL24730803 0.80 ALDH1A1 (0.41) LMNAALDH1A1MEN1PABPC1KMT2A
SCHEMBL15592684 0.77 LMNA (0.46) LMNAALDH1A1MEN1PABPC1KMT2A
SCHEMBL14242461 0.76 ALDH1A1 (0.38) LMNAALDH1A1MEN1PABPC1KMT2A
SCHEMBL15601778 0.75 LMNA (0.46) LMNAALDH1A1MEN1PABPC1KMT2A
SCHEMBL26194271 0.74 POLB (0.41) LMNAALDH1A1MEN1PABPC1KMT2A
SCHEMBL23487882 0.74 HCAR3 (0.33) HCAR3SMN1; SMN2ADORA2AADORA1
SCHEMBL21126519 0.73 ALDH1A1 (0.53) LMNAALDH1A1MEN1PABPC1KMT2A
SCHEMBL6691913 0.71 ALDH1A1 (0.51) LMNAALDH1A1MEN1PABPC1KMT2A

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-20150290200-A1 INTRACELLULAR KINASE INHIBITORS PHARMACYCLICS INC (US) 2015-10-15 US disclosed
US-20140080833-A1 INTRACELLULAR KINASE INHIBITORS MANNKIND CORPORATION (US) 2014-03-20 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-20150290200-A1 INTRACELLULAR KINASE INHIBITORS PI4KB, BTK, LTK LMNA 4556/4885ALDH1A1 4370/4885MEN1 1596/4885
US-20140080833-A1 INTRACELLULAR KINASE INHIBITORS PI4KB, BTK, LTK LMNA 4556/4885ALDH1A1 4370/4885MEN1 1596/4885

“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.