SCHEMBL9550987

SCHEMBL9550987

Nc1cccc(-c2ccccc2-c2cc(N)ccc2-c2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.57
PTPRC P08575 2/20 0.55
ALDH1A1 P00352 5/20 0.50
MEN1 O00255 3/20 0.50
LMNA P02545 3/20 0.50
HPGD P15428 3/20 0.50
KMT2A Q03164 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
APAF1 O14727 1/20 0.50
TDP2 O95551 1/20 0.50
NSD2 O96028 1/20 0.50
PLA2G1B P04054 1/20 0.50
POLB P06746 1/20 0.50
CTSL P07711 1/20 0.50
ALOX12 P18054 1/20 0.50
PLCG1 P19174 1/20 0.50
CTSS P25774 1/20 0.50
NPY1R P25929 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
SCHEMBL8341652 1.00 MAOA (0.57) MAOAPTPRCALDH1A1MEN1LMNA
SCHEMBL2989031 0.96 MAOA (0.57) MAOAPTPRCALDH1A1MEN1LMNA
SCHEMBL1099351 0.96 MAOA (0.57) MAOAPTPRCALDH1A1MEN1LMNA
SCHEMBL756118 0.92 MAOA (0.61) MAOAPTPRCALDH1A1MEN1LMNA
SCHEMBL16820312 0.92 PTPRC (0.63) MAOAPTPRCALDH1A1MEN1LMNA
SCHEMBL7642404 0.90 MAOA (0.70) MAOAALDH1A1MEN1LMNAHPGD
SCHEMBL30449021 0.90 MAOA (0.70) MAOAALDH1A1MEN1LMNAHPGD
SCHEMBL29726725 0.90 MAOA (0.70) MAOAALDH1A1MEN1LMNAHPGD
SCHEMBL29634747 0.88 PTPRC (0.59) MAOAPTPRCALDH1A1MEN1LMNA
SCHEMBL29637424 0.88 ALDH1A1 (0.57) MAOAPTPRCALDH1A1MEN1LMNA

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
US-5208066-A Electronics HITACHI, LTD. (JP) 1993-05-04 US disclosed