SCHEMBL9900475

SCHEMBL9900475

[c]1cnc(-n2cccn2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.48
ALDH1A1 P00352 4/20 0.48
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 2/20 0.39
GLA P06280 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 3/20 0.38
HTT P42858 1/20 0.36
MEN1 O00255 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
G6PD P11413 1/20 0.36
NOTUM Q6P988 1/20 0.35
TDO2 P48775 1/20 0.35
GRM5 P41594 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL29606764 0.71 KDM4E (0.64) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL904382 0.71 KDM4E (0.64) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL896782 0.70 LMNA (0.45) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL14860938 0.70 CYP2A6 (0.37) KDM4EALDH1A1LMNASMN1; SMN2GLA
SCHEMBL29115893 0.70 KDM4E (0.58) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL27345553 0.68 KDM4E (0.50) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL10136885 0.68 KDM4E (0.50) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL12186846 0.68 KDM4E (0.50) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL18708287 0.68 KDM4E (0.50) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL24921470 0.68 KDM4E (0.46) KDM4EALDH1A1LMNASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 US claimed
EP-2796456-A1 Bicyclic compounds as Pim inhibitors Amgen Inc. (US) 2014-10-29 EP claimed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 US claimed
EP-2649065-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2013-10-16 EP claimed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 WO claimed
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 US disclosed
EP-2796456-A1 Bicyclic compounds as Pim inhibitors Amgen Inc. (US) 2014-10-29 EP disclosed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 US disclosed
EP-2649065-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2013-10-16 EP disclosed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 WO 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-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS PIM1, PIM2, PIM3 KDM4E 539/4885ALDH1A1 502/4885LMNA 2103/4885

“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.