SCHEMBL8970607

SCHEMBL8970607

CC(=O)Oc1ccc(N(C)C(C)=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.57
POLB P06746 2/20 0.57
LMNA P02545 2/20 0.55
SRD5A1 P18405 6/20 0.52
ALDH1A1 P00352 3/20 0.51
HTT P42858 1/20 0.51
MAPT P10636 2/20 0.50
PKM P14618 1/20 0.50
GFER P55789 1/20 0.50
MAPK1 P28482 1/20 0.50
ELANE P08246 1/20 0.48
RAB9A P51151 3/20 0.47
NPC1 O15118 1/20 0.47
HSD17B10 Q99714 2/20 0.47

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
SCHEMBL2170993 0.83 LMNA (0.59) SMN1; SMN2POLBLMNAALDH1A1MAPT
SCHEMBL9591439 0.83 SRD5A1 (0.52) SMN1; SMN2POLBLMNASRD5A1ALDH1A1
SCHEMBL14341655 0.82 SMN1; SMN2 (0.61) SMN1; SMN2POLBLMNASRD5A1ALDH1A1
SCHEMBL4099023 0.82 LMNA (0.48) SMN1; SMN2POLBLMNAALDH1A1MAPT
SCHEMBL2537515 0.82 ALDH1A1 (0.71) SMN1; SMN2POLBLMNASRD5A1ALDH1A1
SCHEMBL17471507 0.80 PTGS2 (0.60) SMN1; SMN2POLBLMNASRD5A1ALDH1A1
SCHEMBL2537514 0.80 SMN1; SMN2 (0.57) SMN1; SMN2POLBLMNASRD5A1ALDH1A1
SCHEMBL269329 0.80 LMNA (0.80) SMN1; SMN2POLBLMNAALDH1A1MAPT
SCHEMBL463663 0.79 LMNA (0.59) SMN1; SMN2POLBLMNAALDH1A1MAPT
SCHEMBL992564 0.79 RAB9A (0.50) SMN1; SMN2POLBLMNASRD5A1ALDH1A1

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
US-5527816-A AGRICULTURAL USE ROHM AND HAAS COMPANY (US) 1996-06-18 US disclosed
EP-0529974-A1 Fungicidal 2-aryl-2-cyano-2-(aryloxyalkyl)ethyl-1,2,4-triazoles ROHM AND HAAS COMPANY (US) 1993-03-03 EP disclosed
EP-0053940-B1 POLY(ESTER-AMIDE) CAPABLE OF FORMING AN ANISOTROPIC MELT PHASE DERIVED FROM 6-HYDROXY-2-NAPHTHOIC ACID, DICARBOXYLIC ACID AND AROMATIC MONOMER CAPABLE OF FORMING AN AMIDE LINKAGE CELANESE CORPORATION (US) 1985-04-03 EP disclosed
EP-0007715-B1 THERMOTROPIC POLYESTERAMIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-02-29 EP disclosed
EP-0053940-A1 Poly(ester-amide) capable of forming an anisotropic melt phase derived from 6-hydroxy-2-naphthoic acid, dicarboxylic acid and aromatic monomer capable of forming an amide linkage CELANESE CORPORATION (US) 1982-06-16 EP disclosed
US-4330457-A Poly(ester-amide) capable of forming an anisotropic melt phase derived from 6-hydroxy-2-naphthoic acid, dicarboxylic acid, and aromatic monomer capable of forming an amide linkage CELANESE CORPORATION (US) 1982-05-18 US disclosed