SCHEMBL1017876

SCHEMBL1017876

Cc1ncc(C(=O)NC2CCCCC2)c(C)n1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
NR3C1 P04150 3/20 0.53
RAB9A P51151 5/20 0.52
NPC1 O15118 3/20 0.52
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 3/20 0.50
POLB P06746 1/20 0.50
GLA P06280 1/20 0.50
MAPK1 P28482 1/20 0.50
CYP1A2 P05177 2/20 0.49
CYP2C19 P33261 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
CNR1 P21554 1/20 0.48
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 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
SCHEMBL1016181 1.00 LMNA (0.56) LMNANR3C1RAB9ANPC1KDM4E
SCHEMBL1014942 1.00 LMNA (0.56) LMNANR3C1RAB9ANPC1KDM4E
SCHEMBL1013682 0.98 LMNA (0.54) LMNANR3C1RAB9ANPC1KDM4E
SCHEMBL1014077 0.92 SMYD3 (0.48) LMNANR3C1RAB9ANPC1KDM4E
SCHEMBL541539 0.85 FLT3 (0.53) LMNANR3C1RAB9ANPC1KDM4E
SCHEMBL1015585 0.83 RAB9A (0.53) LMNANR3C1RAB9ANPC1MEN1
SCHEMBL1014628 0.83 RAB9A (0.53) LMNANR3C1RAB9ANPC1MEN1
SCHEMBL1018675 0.83 HPGD (0.55) LMNANR3C1RAB9ANPC1KDM4E
SCHEMBL1017688 0.83 HPGD (0.55) LMNANR3C1RAB9ANPC1KDM4E
SCHEMBL1014078 0.82 HPGD (0.56) LMNANR3C1RAB9ANPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102066335-A Substituted pyrimidin-5-carboxamides 281 ASTRAZENECA AB 2011-05-18 CN disclosed
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 LMNA 4185/4885NR3C1 971/4885RAB9A 1947/4885

“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.