SCHEMBL10183153

SCHEMBL10183153

CC(C)(C)c1cc2c(cn1)ncn2C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 8/20 0.40
RAB9A P51151 8/20 0.40
SMN1; SMN2 Q16637 5/20 0.40
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 2/20 0.39
LMNA P02545 2/20 0.37
HTT P42858 1/20 0.37
HIF1A Q16665 1/20 0.37
TP53 P04637 2/20 0.37
GAA P10253 3/20 0.35
THRB P10828 1/20 0.35
PI4KA P42356 1/20 0.31
PI4K2B Q8TCG2 1/20 0.31
PI4K2A Q9BTU6 1/20 0.31
PI4KB Q9UBF8 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
SCHEMBL10183099 0.80 DYRK1A (0.38) KMT2ANPC1RAB9ASMN1; SMN2MAPT
SCHEMBL10183626 0.77 EGFR (0.40) NPC1SMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL10233431 0.76 NPC1 (0.44) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL10183102 0.76 ALDH1A1 (0.39) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL10183144 0.76 HCAR3 (0.41) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL10183186 0.75 PI4KA (0.36) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL10183124 0.74 EGFR (0.42) MEN1KMT2ANPC1ALDH1A1HPGD
SCHEMBL10183143 0.74 GAA (0.44) MEN1KMT2ANPC1ALDH1A1HPGD
SCHEMBL23476802 0.73 NPC1 (0.37) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL18136606 0.73 NPC1 (0.50) MEN1KMT2ANPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120040951-A1 HETEROARYL COMPOUNDS USEFUL AS RAF KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. 2012-02-16 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-20120040951-A1 HETEROARYL COMPOUNDS USEFUL AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF MEN1 2395/4885KMT2A 2394/4885NPC1 959/4885

“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.