SCHEMBL1696217

SCHEMBL1696217

Cc1c(-c2ccccc2)n[c]n1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 4/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
AVPR1A P37288 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
PTGS2 P35354 2/20 0.34
HPGD P15428 1/20 0.34
PTGS1 P23219 1/20 0.34
POLB P06746 2/20 0.34
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
ALOX15 P16050 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
SCHEMBL236752 0.79 SMN1; SMN2 (0.37) MEN1KMT2AKDM4ERAB9ANPC1
SCHEMBL8847437 0.79 MEN1 (0.42) MEN1KMT2AALDH1A1KDM4EHTT
SCHEMBL8847707 0.77 TDP1 (0.37) MEN1KMT2AALDH1A1KDM4EHTT
SCHEMBL11772759 0.70 LMNA (0.38) KDM4EHTTRAB9ANPC1SMN1; SMN2
SCHEMBL7266968 0.65 NSD3 (0.42) MEN1KMT2AALDH1A1KDM4EHTT
SCHEMBL8631734 0.65 KMT2A (0.42) MEN1KMT2AALDH1A1KDM4EHSD17B10
SCHEMBL11405385 0.64 MEN1 (0.63) MEN1KMT2AALDH1A1KDM4ERAB9A
SCHEMBL5005046 0.64 MEN1 (0.69) MEN1KMT2AALDH1A1KDM4EHTT
SCHEMBL13325667 0.64 NPC1 (0.62) MEN1KMT2AHTTRAB9ANPC1
SCHEMBL10205951 0.64 MEN1 (0.53) MEN1KMT2AALDH1A1KDM4EHTT

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-2011142381-A1 BENZO- OR PYRIDO-IMIDAZOLE DERIVATIVE FUJITA TAKASHI (JP) 2011-11-17 WO disclosed