SCHEMBL16598261

SCHEMBL16598261

Cn1nccc1Cc1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.44
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
ALOX15 P16050 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
HRH1 P35367 1/20 0.40
HRH4 Q9H3N8 1/20 0.40
KCNH2 Q12809 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LIN28A Q9H9Z2 1/20 0.39
TDP1 Q9NUW8 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
SCHEMBL7757122 0.76 KDM5A (0.43) ALDH1A1LMNAL3MBTL1KCNH2SMN1; SMN2
SCHEMBL16598178 0.75 HRH3 (0.44) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL16598484 0.75 LMNA (0.44) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL29830938 0.73 L3MBTL1 (0.59) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL41191 0.73 L3MBTL1 (0.59) HRH3ALDH1A1LMNATAAR1ALOX15
Ammonia Solution, Strong SCHEMBL6176560 0.71 L3MBTL1 (0.57) HRH3ALDH1A1LMNATAAR1ALOX15
Bromide SCHEMBL6114859 0.71 L3MBTL1 (0.57) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL29715188 0.71 L3MBTL1 (0.57) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL4938201 0.71 L3MBTL1 (0.57) HRH3ALDH1A1LMNATAAR1ALOX15
Hydrochloric Acid SCHEMBL10884973 0.71 L3MBTL1 (0.57) HRH3ALDH1A1LMNATAAR1ALOX15

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-2015048503-A2 N-ARYLMETHYL SULFONAMIDE NEGATIVE MODULATORS OF NR2A MNEMOSYNE PHARMACEUTICALS, INC. (US) 2015-04-02 WO disclosed