SCHEMBL1015585

SCHEMBL1015585

CSc1ncc(C(=O)NC2CCCCCC2)c(C)n1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.53
AHR P35869 1/20 0.52
LMNA P02545 1/20 0.51
NPC1 O15118 2/20 0.51
PDE4B Q07343 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
NR3C1 P04150 2/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
CNR1 P21554 1/20 0.47

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
SCHEMBL1014628 1.00 RAB9A (0.53) RAB9AAHRLMNANPC1PDE4B
SCHEMBL1014765 0.85 RAB9A (0.51) RAB9ALMNAPDE4BGAAMAPT
SCHEMBL1014054 0.85 RAB9A (0.51) RAB9ALMNAPDE4BGAAMAPT
SCHEMBL1017876 0.83 LMNA (0.56) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL1014942 0.83 LMNA (0.56) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL1016181 0.83 LMNA (0.56) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL1013682 0.82 LMNA (0.54) RAB9ALMNANPC1MEN1KMT2A
SCHEMBL1018338 0.82 RAB9A (0.48) RAB9ALMNANPC1PDE4BGAA
SCHEMBL1015077 0.82 RAB9A (0.48) RAB9ALMNANPC1PDE4BGAA
SCHEMBL1014017 0.81 PDE4B (0.61) RAB9APDE4BMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2271629-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 AstraZeneca AB (SE) 2011-01-12 EP disclosed
WO-2009130496-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 ASTRAZENECA AB (SE) 2009-10-29 WO disclosed
US-20090264401-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 ASTRAZENECA AB (SE) 2009-10-22 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-20090264401-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 CYP2S1, HSD11B1, HSD3B1 RAB9A 1947/4885AHR 232/4885LMNA 4185/4885

“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.