SCHEMBL9575719

SCHEMBL9575719

CN(C)C(=O)Nc1ccccc1Oc1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.46
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
SLC6A3 Q01959 1/20 0.45
NPSR1 Q6W5P4 2/20 0.45
ALDH1A1 P00352 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
GAA P10253 1/20 0.44
PKM P14618 1/20 0.44
CXCL8 P10145 1/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
APEX1 P27695 1/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TSHR P16473 1/20 0.42
MAPT P10636 2/20 0.42

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
SCHEMBL6452004 0.84 L3MBTL1 (0.54) SLC6A2SLC6A4SLC6A3NPSR1ALDH1A1
SCHEMBL560265 0.82 CYP1A2 (0.55) NPSR1ALDH1A1NPC1RAB9AHPGD
SCHEMBL11446051 0.81 APEX1 (0.61) XIAPALDH1A1APEX1TSHR
SCHEMBL1701888 0.81 XIAP (0.65) XIAPNPSR1ALDH1A1NPC1RAB9A
SCHEMBL7088595 0.79 ALDH1A1 (0.57) ALDH1A1NPC1RAB9AGAAPKM
SCHEMBL30163598 0.79 ALDH1A1 (0.57) ALDH1A1NPC1RAB9AGAAPKM
SCHEMBL11685131 0.78 L3MBTL1 (0.44) NPSR1ALDH1A1NPC1RAB9AGAA
SCHEMBL11688775 0.77 LIPE (0.50) ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL30761772 0.76 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2TSHRHTT
SCHEMBL7089269 0.76 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2TSHRHTT

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-5214190-A Nitrophenyl ether herbicides JOHNSON WAYNE O (US) 1993-05-25 US disclosed
US-4894479-A CARBONYLOXYAMINO DERIVATIVES ROHM AND HAAS COMPANY (US) 1990-01-16 US disclosed
US-4029687-A HERBICIDES CIBA-GEIGY AG (CH) 1977-06-14 US disclosed
US-4004914-A HERBICIDES CIBA-GEIGY AG (CH) 1977-01-25 US disclosed
US-3951641-A Use of N-(4-isopropoxy-3-chlorophenyl)-N'-methyl-N'-methoxyurea for control of weeds in maize cultures CIBA-GEIGY AG (CH) 1976-04-20 US disclosed