SCHEMBL14308134

SCHEMBL14308134

Cc1ccc(NCCCN(C)C)cn1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ POLB P06746 2/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ CHEK1 O14757 1/20 0.42
▸ RAD52 P43351 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ SLC2A1 P11166 1/20 0.42
▸ APOBEC3A P31941 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ APOBEC3G Q9HC16 1/20 0.42
▸ DRD3 P35462 1/20 0.41
▸ APAF1 O14727 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ CASP6 P55212 1/20 0.40
▸ CASP8 Q14790 1/20 0.40
▸ BRD4 O60885 1/20 0.39
▸ ATAD2 Q6PL18 1/20 0.39

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
SCHEMBL28324750 0.82 KDM4E (0.43) L3MBTL1KDM4EPOLBCHEK1RAD52
SCHEMBL14197601 0.81 RRM2 (0.48) KDM4ENPC1KMT2A
SCHEMBL18386498 0.78 KCNH3 (0.48) —
SCHEMBL21388439 0.77 MAPT (0.61) L3MBTL1KDM4EPOLBALOX15RAD52
SCHEMBL12697198 0.77 RRM2 (0.46) KDM4E
SCHEMBL23405971 0.76 L3MBTL1 (0.50) L3MBTL1KDM4EPOLBALOX15RAD52
SCHEMBL29744105 0.76 L3MBTL1 (0.50) L3MBTL1KDM4EPOLBALOX15RAD52
SCHEMBL25650053 0.75 STK17A (0.42) CHEK1
SCHEMBL9347587 0.75 NPSR1 (0.40) KDM4ENPC1RAB9AKMT2A
SCHEMBL20037762 0.75 MAPT (0.43) KDM4ENPC1RAB9A

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
WO-2008007123-A2 PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2008-01-17 — — WO disclosed
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