SCHEMBL6472289

SCHEMBL6472289

Cc1ccnc(NC(=O)C2(N)CCCCC2)n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FASN P49327 1/20 0.41
SORT1 Q99523 1/20 0.40
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
MEN1 O00255 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KCNH2 Q12809 1/20 0.38
GAA P10253 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL6472501 0.78 HDAC3 (0.38) L3MBTL1NPC1RAB9APOLBMAPT
SCHEMBL6472291 0.76 KMT2A (0.40) L3MBTL1KDM4EKMT2ANPC1RAB9A
SCHEMBL15881328 0.74 L3MBTL1 (0.55) L3MBTL1KDM4EKMT2ANPC1RAB9A
SCHEMBL14298343 0.73 L3MBTL1 (0.54) L3MBTL1KDM4EKMT2ANPC1RAB9A
SCHEMBL6719477 0.71 MAPT (0.50) KDM4ENPC1RAB9APOLBSMN1; SMN2
SCHEMBL29141778 0.70 NPC1 (0.55) L3MBTL1KDM4EKMT2ANPC1RAB9A
SCHEMBL19699460 0.70 L3MBTL1 (0.51) L3MBTL1KDM4EKMT2ANPC1RAB9A
SCHEMBL29155745 0.70 POLB (0.64) L3MBTL1KDM4EKMT2ANPC1RAB9A
SCHEMBL6360506 0.69 KDM4E (0.52) L3MBTL1KDM4EKMT2ANPC1RAB9A
SCHEMBL4774475 0.69 L3MBTL1 (0.50) L3MBTL1KDM4EKMT2ANPC1RAB9A

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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO., LTD. 2005-09-08 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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof HCRTR2, MCHR1, MCHR2 L3MBTL1 3949/4885KDM4E 1190/4885KMT2A 693/4885

“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.