SCHEMBL8943463

SCHEMBL8943463

NC(=O)c1cccc(Cc2cccc(C(N)=O)c2N)c1N

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.45
LMNA P02545 1/20 0.45
PTGS1 P23219 1/20 0.45
ADORA1 P30542 1/20 0.45
PTGS2 P35354 1/20 0.45
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
METAP2 P50579 1/20 0.41
GAA P10253 1/20 0.40

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
SCHEMBL10604934 0.87 PLA2G2A (0.49) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL5545298 0.86 PARP1 (0.46) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL27723424 0.86 KDM4E (0.42) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL3622854 0.86 PARP1 (0.47) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL14899751 0.84 KDM4E (0.41) ABCB11LMNAPTGS1ADORA1PTGS2
Ammonia Solution, Strong SCHEMBL17727872 0.84 PARP1 (0.46) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL4444648 0.83 G6PD (0.59) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL30934865 0.83 G6PD (0.59) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL5718302 0.83 CYP17A1 (0.46) ABCB11LMNAPTGS1ADORA1PTGS2
SCHEMBL3829415 0.82 KDM4E (0.44) ABCB11LMNAPTGS1ADORA1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5489644-A COMPRISING AROMATIC DIAMINES AND TETRAESTER OF AROMATIC TETRACARBOXYLIC ACID; PROTECTIVE COATING FOR METALS, SILICON WAFERS, GLASS BASF LACKE + FARBEN (DE) 1996-02-06 US disclosed
US-5474876-A Carboxyl-containing polymeric precursor of heterocyclic polymer which is stable at high temperatures and soluble in polar solvents, copolymerizable unsaturated tertiary sulfonium salt, photoinitiator, polar aprotic organic solvent BASF LACKE + FARBEN AG (DE) 1995-12-12 US disclosed
US-5332799-A Aromatic diamines, diesters of aromatic tetracarboxylic acids, circuit coatings BASF LACKE+FARBEN AKTIENGESELLSCHAFT (DE) 1994-07-26 US disclosed
US-5264545-A Aromatic or partly aromatic diamine with tetracarboxylic acid BASF LACKE+FARBEN AKTIENGESELLSCHAFT (DE) 1993-11-23 US disclosed