SCHEMBL7907377

SCHEMBL7907377

C=C(C)C(=O)NCC(C)Oc1ccc2c(C)cc(=O)oc2c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IGLV6-57 P01721 3/20 0.59
ALDH1A1 P00352 10/20 0.59
KDM4E B2RXH2 8/20 0.59
HPGD P15428 5/20 0.59
HSD17B10 Q99714 5/20 0.59
ALDH2 P05091 1/20 0.58
HTT P42858 2/20 0.56
MAPK1 P28482 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
GLA P06280 3/20 0.55
GAA P10253 3/20 0.55
AR P10275 2/20 0.54
KMT2A Q03164 6/20 0.53
MAPT P10636 2/20 0.53
TP53 P04637 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.51
MEN1 O00255 2/20 0.50
NPBWR1 P48145 1/20 0.50

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
SCHEMBL7915718 0.83 CA12 (0.52) ALDH1A1KDM4EHPGDHSD17B10HTT
SCHEMBL27231058 0.83 ALDH1A1 (0.63) IGLV6-57ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL8834944 0.82 IGLV6-57 (0.58) IGLV6-57ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL27214687 0.81 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDHSD17B10ALDH2
SCHEMBL7917181 0.81 ALDH1A1 (0.60) IGLV6-57ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL7915768 0.80 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDHSD17B10ALDH2
SCHEMBL22501552 0.79 KDM4E (0.74) IGLV6-57ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13726250 0.77 ALDH1A1 (0.64) IGLV6-57ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL20537229 0.76 KDM4E (0.78) IGLV6-57ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL14176760 0.76 KDM4E (1.00) IGLV6-57ALDH1A1KDM4EHPGDHSD17B10

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-6201087-B1 POLYMERS WHICH CONTAIN COUMARIN OR QUINOLINONE DERIVATIVES AS PHOTOREACTIVE UNITS AS ORIENTING LAYERS FOR LIQUID CRYSTALS; PHOTOCHEMICAL STABILITY AND IMPROVED CONTRAST ROLIC AG (CH) 2001-03-13 US disclosed
EP-0783537-B1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS ROLIC AG (CH) 1999-12-01 EP disclosed