SCHEMBL8433192

SCHEMBL8433192

O=C(COc1ccc(Br)cc1)NC(Cc1ccccc1)(Cc1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.57
POLB P06746 3/20 0.57
MEN1 O00255 3/20 0.57
MAPT P10636 2/20 0.49
KDM4E B2RXH2 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 3/20 0.48
NPC1 O15118 1/20 0.48
LMNA P02545 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
GPR183 P32249 1/20 0.46
HPGD P15428 1/20 0.46
GAA P10253 1/20 0.45
CYP2C19 P33261 1/20 0.45
SGMS1 Q86VZ5 1/20 0.45

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
SCHEMBL8079894 0.82 KMT2A (0.57) KMT2APOLBMEN1MAPTKDM4E
SCHEMBL8434118 0.76 CYP1A2 (0.48) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL18177840 0.73 ALDH1A1 (0.76) KMT2APOLBMEN1MAPTKDM4E
SCHEMBL15145811 0.71 POLB (0.74) KMT2APOLBMEN1MAPTKDM4E
SCHEMBL8290704 0.70 ALDH1A1 (0.61) KMT2APOLBMEN1MAPTKDM4E
SCHEMBL2795569 0.70 GPR183 (0.63) KMT2APOLBMEN1MAPTKDM4E
SCHEMBL1819229 0.70 MAPT (0.58) KMT2APOLBMEN1MAPTKDM4E
SCHEMBL11222973 0.69 MAPT (0.61) KMT2APOLBMEN1MAPTKDM4E
SCHEMBL7266077 0.69 RECQL (0.65) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL2798066 0.68 POLB (0.72) KMT2APOLBMEN1GPR183GAA

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-5965763-A Biphenyl compounds HOECHST MARION ROUSSEL (FR) 1999-10-12 US disclosed
US-5827887-A 5-ALPHA REDUCTASE INHIBITORS ROUSSEL UCLAF (FR) 1998-10-27 US disclosed