SCHEMBL6403088

SCHEMBL6403088

S=C(Cc1nc2ccccc2[nH]1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.57
MAPT P10636 8/20 0.57
NPC1 O15118 8/20 0.57
KDM4E B2RXH2 7/20 0.57
SMN1; SMN2 Q16637 6/20 0.57
GAA P10253 4/20 0.57
TDP1 Q9NUW8 4/20 0.57
HPGD P15428 2/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
RAB9A P51151 7/20 0.54
DDAH1 O94760 1/20 0.53
POLB P06746 1/20 0.53
CHRM1 P11229 1/20 0.53
HSD17B10 Q99714 2/20 0.52
LMNA P02545 2/20 0.51
THRB P10828 1/20 0.51
HTT P42858 1/20 0.51
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50

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
SCHEMBL10892813 0.85 GAA (0.59) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2
SCHEMBL5849893 0.81 MAPT (0.78) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2
SCHEMBL8017570 0.81 ALDH1A1 (0.57) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2
SCHEMBL7435327 0.80 DDAH1 (0.56) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL5849632 0.79 MAPT (0.76) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2
SCHEMBL10762453 0.79 SMN1; SMN2 (0.57) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2
SCHEMBL761148 0.78 CHRM1 (0.71) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2
SCHEMBL11450998 0.77 SMN1; SMN2 (0.68) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2
SCHEMBL12858620 0.77 ALDH1A1 (0.71) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2
SCHEMBL11017414 0.76 ALDH1A1 (0.58) ALDH1A1MAPTNPC1KDM4ESMN1; SMN2

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-6919389-B2 Polymer compositions containing benzimidazole based stabilizer compounds CROMPTON CORPORATION (US) 2005-07-19 US disclosed
US-20040180995-A1 Polymer compositions containing benzimidazole based stabilizer compounds ADDIVANT USA, LLC 2004-09-16 US disclosed