SCHEMBL9155261

SCHEMBL9155261

O=C(O)Cc1cc(=O)[nH]c2cc(Br)ccc12

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR17 Q13304 1/20 0.48
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
MAPT P10636 2/20 0.41
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 2/20 0.40
MITF O75030 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GLA P06280 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
METAP2 P50579 1/20 0.40
MPL P40238 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL9157138 0.83 EGFR (0.44) KMT2AMEN1MAPTALDH1A1KDM4E
SCHEMBL1776571 0.82 TSHR (0.52) KMT2AMEN1ALDH1A1KDM4EMITF
SCHEMBL9160411 0.80 CHEK1 (0.49) GPR17KMT2AMEN1ALDH1A1KDM4E
SCHEMBL8366302 0.80 ALDH1A1 (0.59) KMT2AMEN1MAPTALDH1A1KDM4E
SCHEMBL31376496 0.80 ALDH1A1 (0.59) KMT2AMEN1MAPTALDH1A1KDM4E
SCHEMBL4484622 0.78 ALDH1A1 (0.56) GPR17KMT2AMEN1MAPTALDH1A1
SCHEMBL29544940 0.78 ALDH1A1 (0.56) GPR17KMT2AMEN1MAPTALDH1A1
SCHEMBL9156800 0.78 METAP2 (0.42) GPR17KMT2AMEN1MAPTKDM4E
SCHEMBL29831055 0.77 KDM4E (0.59) ALDH1A1KDM4EHPGDGLAMETAP2
SCHEMBL14796728 0.77 KDM4E (0.59) ALDH1A1KDM4EHPGDGLAMETAP2

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-5457099-A Carbostyril derivatives and antiallergic agent SAWAI PHARMACEUTICAL CO., LTD. (JP) 1995-10-10 US disclosed
EP-0577325-A1 Carbostyril derivatives and antiallergic agent SAWAI PHARMACEUTICAL CO., LTD. (JP) 1994-01-05 EP disclosed