SCHEMBL13680711

SCHEMBL13680711

Cc1ccc(-c2cnc(Cl)nc2)o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
HPGD P15428 4/20 0.39
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
GAA P10253 2/20 0.39
TSHR P16473 2/20 0.39
LMNA P02545 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GSK3B P49841 9/20 0.38
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
MAPT P10636 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
PKM P14618 2/20 0.35
ALOX15 P16050 1/20 0.35
GLA P06280 1/20 0.35

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
SCHEMBL13680715 0.83 TDP1 (0.42) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL13680718 0.80 ALDH1A1 (0.39) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL14934107 0.78 KDM4E (0.36) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL13680518 0.77 MAPT (0.41) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL13680700 0.77 MAP4K4 (0.41) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL13680720 0.77 GSK3B (0.38) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL13680709 0.77 GRM5 (0.37) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL13680469 0.76 NPC1 (0.42) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL13680704 0.76 SMN1; SMN2 (0.53) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL13681360 0.76 ALDH1A1 (0.40) ALDH1A1HPGDKDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed