SCHEMBL8640487

SCHEMBL8640487

CCCCCNC1C=COc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
SCN2A Q99250 1/20 0.41
MAPT P10636 2/20 0.39
SIGMAR1 Q99720 1/20 0.34
ALOX15 P16050 1/20 0.34
KDM4E B2RXH2 1/20 0.32
NLRP3 Q96P20 1/20 0.32
GLB1 P16278 3/20 0.32
NAAA Q02083 1/20 0.32
HPGD P15428 1/20 0.32
CCR1 P32246 1/20 0.31
TP53 P04637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
EPHX1 P07099 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL7065657 0.74 BCHE (0.46) KMT2AMEN1BCHEACHESCN2A
SCHEMBL1752692 0.74 KMT2A (0.38) KMT2AMEN1BCHEACHEMAPT
SCHEMBL4925470 0.72 BCHE (0.60) KMT2AMEN1BCHEACHEMAPT
SCHEMBL4642628 0.71 BCHE (0.50) KMT2AMEN1BCHEACHESCN2A
SCHEMBL6413848 0.68 HTR2A (0.51) KMT2AMEN1BCHEACHEMAPT
SCHEMBL9287125 0.66 BCHE (0.51) KMT2AMEN1BCHEACHESCN2A
SCHEMBL3259666 0.66 BCHE (0.89) KMT2AMEN1BCHEACHESIGMAR1
SCHEMBL4721968 0.64 BCHE (0.49) KMT2AMEN1BCHEACHEMAPT
SCHEMBL4722883 0.62 BCHE (0.46) KMT2AMEN1BCHEACHEMAPT
SCHEMBL29004430 0.62 SIGMAR1 (0.40) KMT2AMEN1BCHEACHESIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5837702-A HAVING POTASSIUM CHANNEL ACTIVATING ACTIVITY USEFUL AS CARDIOVASCULAR AGENTS AND TREATMENT OF ISCHEMIA BRISTOL-MYERS SQUIBB CO. (US) 1998-11-17 US disclosed
US-5629429-A Process for preparing 4-arylamino-benzopyran and related compounds BRISTOL-MYERS SQUIBB COMPANY (US) 1997-05-13 US disclosed
CN-1107473-A 4-Arylamino-benzopyran and related compounds BRISTOL MYERS SQUIBB CO (US) 1995-08-30 CN disclosed
CN-1107473-A 4-Arylamino-benzopyran and related compounds BRISTOL MYERS SQUIBB CO (US) 1995-08-30 CN disclosed
EP-0648758-A1 4-Arylamino-benzopyran and related compounds BRISTOL-MYERS SQUIBB COMPANY (US) 1995-04-19 EP disclosed