SCHEMBL11604657

SCHEMBL11604657

CCCCNS(=O)(=O)Nc1ncccc1C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
HPGD P15428 3/20 0.46
KDM4E B2RXH2 3/20 0.46
HSD17B10 Q99714 2/20 0.46
CNR2 P34972 1/20 0.43
CA12 O43570 2/20 0.42
CA9 Q16790 1/20 0.42
EDNRB P24530 2/20 0.42
EDNRA P25101 2/20 0.42
BDKRB1 P46663 1/20 0.42
CA14 Q9ULX7 1/20 0.42
RIPK1 Q13546 1/20 0.41
RAB9A P51151 1/20 0.41
POLB P06746 2/20 0.41
HTT P42858 1/20 0.41
SLC40A1 Q9NP59 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
PKM P14618 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL11607709 0.93 KDM4E (0.48) ALDH1A1HPGDKDM4EHSD17B10CNR2
SCHEMBL11612201 0.87 SLC40A1 (0.46) ALDH1A1HPGDKDM4EHSD17B10CNR2
SCHEMBL7437816 0.82 ALDH1A1 (0.59) ALDH1A1HPGDKDM4EHSD17B10CNR2
SCHEMBL11612426 0.81 CNR2 (0.44) ALDH1A1HPGDKDM4ECNR2CA12
SCHEMBL11604345 0.80 CNR2 (0.49) ALDH1A1HPGDKDM4ECNR2CA9
SCHEMBL11629138 0.79 SMN1; SMN2 (0.45) ALDH1A1HPGDKDM4EHSD17B10CA12
SCHEMBL11605246 0.79 EDNRB (0.40) ALDH1A1CA12CA9EDNRBEDNRA
SCHEMBL14575165 0.77 CNR2 (0.51) ALDH1A1HPGDKDM4EHSD17B10CNR2
SCHEMBL11607474 0.77 ALDH1A1 (0.46) ALDH1A1HPGDKDM4ECNR2CA9
SCHEMBL4771680 0.76 KDM4E (0.71) ALDH1A1HPGDKDM4EHSD17B10CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4014888-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1977-03-29 US claimed
US-4129734-A HERBICIDE THE DOW CHEMICAL COMPANY (US) 1978-12-12 US disclosed
US-4128553-A HERBICIDE THE DOW CHEMICAL COMPANY (US) 1978-12-05 US disclosed
US-4128551-A HERBICIDE THE DOW CHEMICAL CO. (US) 1978-12-05 US disclosed
US-4098792-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1978-07-04 US disclosed
US-4085279-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1978-04-18 US disclosed
US-4085278-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1978-04-18 US disclosed
US-4082758-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1978-04-04 US disclosed
US-4082759-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1978-04-04 US disclosed
US-4058533-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1977-11-15 US disclosed
US-4014888-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1977-03-29 US disclosed
US-3989507-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1976-11-02 US disclosed