SCHEMBL8555101

SCHEMBL8555101

Cc1cccc2c1N(C)C(=O)CC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 3/20 0.46
ALOX12 P18054 1/20 0.46
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
BRD4 O60885 2/20 0.42
MAP2K1 Q02750 1/20 0.41
AADAT Q8N5Z0 1/20 0.41
HTR2B P41595 3/20 0.39
OPRM1 P35372 1/20 0.39
CNR2 P34972 1/20 0.38
HTR2C P28335 1/20 0.38
HTR1A P08908 1/20 0.38
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
USP2 O75604 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL30404908 0.83 KMT2A (0.46) ALOX12ALDH1A1MEN1POLBKMT2A
SCHEMBL11630037 0.83 KMT2A (0.46) ALOX12ALDH1A1MEN1POLBKMT2A
SCHEMBL10889128 0.81 SRD5A1 (0.46) SRD5A1ALOX12POLBBRD4MAP2K1
SCHEMBL30062459 0.80 ALOX12 (0.45) SRD5A1ALOX12ALDH1A1MEN1POLB
SCHEMBL11272489 0.80 SRD5A1 (0.45) SRD5A1BRD4MAP2K1HTR1ACYP17A1
SCHEMBL11270465 0.80 NOTUM (0.49) SRD5A1POLBMAP2K1AADATHTR2B
SCHEMBL10889135 0.80 SRD5A1 (0.45) SRD5A1ALDH1A1MEN1KMT2AMAP2K1
SCHEMBL8551856 0.80 SRD5A1 (0.45) SRD5A1MEN1KMT2ABRD4MAP2K1
SCHEMBL3588020 0.80 SRD5A1 (0.45) SRD5A1ALOX12POLBBRD4MAP2K1
SCHEMBL3588021 0.80 SRD5A1 (0.45) SRD5A1ALDH1A1MEN1KMT2ABRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623614-B1 4-Aryl-4-hydroxy-tetrahydropyrans and 3-aryl-3-hydroxy-tetrahydrofurans as 5-lipoxygenase inhibitors ZENECA LTD (GB) 1998-02-25 EP disclosed
US-5512594-A ADMINISTERING TO TREAT A MEDICAL CONDITION MEDIATED BY ONE OR MORE LEUKOTRIENES ZENECA LIMITED (GB) 1996-04-30 US disclosed
US-5478842-A Antiinflammatory agents, antiallergens, drugs for treatment of diseases mediated by leukotrienes ZENECA LIMITED (GB) 1995-12-26 US disclosed
WO-1994025453-A1 4-ARYL-4-HYDROXY-TETRAHYDROPYRANS AND 3-ARYL-3-HYDROXY-TETRAHYDROFURANS AS 5-LIPOXYGENASE INHIBITORS ZENECA LIMITED (GB) 1994-11-10 WO disclosed
EP-0623614-A1 4-Aryl-4-hydroxy-tetrahydropyrans and 3-aryl-3-hydroxy-tetrahydrofurans as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1994-11-09 EP disclosed
US-4349554-A Method of using carbostyril derivatives as plant fungicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-09-14 US disclosed