SCHEMBL27604752

SCHEMBL27604752

C=C(C)C(=O)c1cccc(C(=O)c2ccccc2)c1N

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
GAA P10253 1/20 0.51
AKR1C3 P42330 1/20 0.46
ADORA1 P30542 2/20 0.45
ELANE P08246 1/20 0.43
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
GLA P06280 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPK14 Q16539 2/20 0.42
MYC P01106 1/20 0.42
PBRM1 Q86U86 1/20 0.42
POLB P06746 1/20 0.41
ABCB11 O95342 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL30200107 0.84 AKR1C3 (0.59) MAPTGAAAKR1C3ELANELMNA
SCHEMBL1892977 0.84 AKR1C3 (0.59) MAPTGAAAKR1C3ELANELMNA
SCHEMBL7080087 0.83 G6PD (0.53) MAPTGAALMNAALDH1A1MEN1
Ammonia Solution, Strong SCHEMBL28386096 0.81 MAPT (0.56) MAPTGAAAKR1C3ADORA1LMNA
SCHEMBL2690787 0.79 AKR1C3 (0.67) MAPTGAAAKR1C3ADORA1LMNA
SCHEMBL5807536 0.78 MAPT (0.60) MAPTGAAAKR1C3ADORA1LMNA
SCHEMBL2760394 0.76 GAA (0.58) MAPTGAAAKR1C3LMNAALDH1A1
SCHEMBL8656438 0.76 MAPT (0.81) MAPTGAAAKR1C3ADORA1LMNA
SCHEMBL10829823 0.76 MAPT (0.58) MAPTGAAAKR1C3ADORA1LMNA
Hydrochloric Acid SCHEMBL27668320 0.76 MAPT (0.58) MAPTGAAAKR1C3ADORA1LMNA

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
CN-100528989-C Anion electroplating paint and finished articles KANSAI PAINT CO LTD (JP) 2009-08-19 CN disclosed
CN-1673295-A Anion electroplating paint and finished articles KANSAI PAINT CO LTD (JP) 2005-09-28 CN disclosed