SCHEMBL7067009

SCHEMBL7067009

CCON=C(C(=O)NC)c1ccccc1COc1cc(C)ccc1C

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 2/20 0.39
LMNA P02545 1/20 0.39
HIF1A Q16665 2/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
HPGD P15428 1/20 0.38
KCNMA1 Q12791 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL8519540 1.00 ALDH1A1 (0.42) ALDH1A1MEN1KMT2APTGDR2SMN1; SMN2
SCHEMBL8650356 0.91 ALDH1A1 (0.41) ALDH1A1MEN1KMT2APTGDR2SMN1; SMN2
SCHEMBL8396410 0.91 ALDH1A1 (0.41) ALDH1A1MEN1KMT2APTGDR2SMN1; SMN2
SCHEMBL8396415 0.91 ALDH1A1 (0.41) ALDH1A1MEN1KMT2APTGDR2SMN1; SMN2
SCHEMBL8622366 0.89 PTGDR2 (0.44) ALDH1A1MEN1KMT2APTGDR2SMN1; SMN2
SCHEMBL31349879 0.89 HIF1A (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL29673995 0.89 HIF1A (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL8622364 0.89 PTGDR2 (0.44) ALDH1A1MEN1KMT2APTGDR2SMN1; SMN2
SCHEMBL22326129 0.89 HIF1A (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL18420 0.89 HIF1A (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6762321-B2 SUCH AS N-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-3-DIFLUOROMETHOXY-2-(4 -METHYLPHENYL)ACRYLAMIDE; FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-07-13 US disclosed
EP-1295868-A1 AMIDE COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-26 EP disclosed
EP-0644183-B1 Process of producing N-alkylacetamides SHIONOGI & CO (JP) 1999-06-02 EP disclosed
EP-0658541-B1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO (JP) 1998-05-20 EP disclosed
US-5510506-A Process for producing carboxylic acid derivatives SHIONOGI & CO., LTD. (JP) 1996-04-23 US disclosed
US-5498792-A Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1996-03-12 US disclosed
EP-0658541-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 1995-06-21 EP disclosed