SCHEMBL6920338

SCHEMBL6920338

CCOC(=NO)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
MAPT P10636 4/20 0.44
NPC1 O15118 2/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
ATM Q13315 1/20 0.42
LMNA P02545 2/20 0.41
TSHR P16473 1/20 0.41
GAA P10253 2/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 2/20 0.40
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL10361965 0.82 ESR1 (0.55) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL13273168 0.82 MEN1 (0.43) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL10075193 0.82 MEN1 (0.43) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL10694796 0.81 TSHR (0.47) MAPTNPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL11207345 0.79 AKR1C3 (0.49) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL28170963 0.79 RAB9A (0.60) MEN1KMT2AMAPTALDH1A1ATM
SCHEMBL27849629 0.79 TSHR (0.46) KMT2AMAPTSMN1; SMN2ATMLMNA
SCHEMBL6820105 0.78 LMNA (0.50) MAPTNPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL28863986 0.78 TDP1 (0.55) KMT2AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL22208244 0.77 MEN1 (0.47) MEN1KMT2AMAPTNPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004067518-A1 SUBSTITUTED PYRIMIDINES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-08-12 WO disclosed
EP-0647217-B1 4-ACYLAMINOBENZAMIDES AND THEIR USE AS FUNGICIDES ZENECA LTD (GB) 1997-10-29 EP disclosed
EP-0334863-B1 PROCESS FOR THE PREPARATION OF ORGANO N-HYDROXYIMIDATES AlliedSignal Inc. (US) 1992-04-15 EP disclosed
EP-0334863-A1 PROCESS FOR THE PREPARATION OF ORGANO N-HYDROXYIMIDATES. ALLIED CORP (US) 1989-10-04 EP disclosed
WO-1988004291-A1 PROCESS FOR THE PREPARATION OF ORGANO N-HYDROXYIMIDATES ALLIED CORPORATION (US) 1988-06-16 WO disclosed
US-4743701-A Process for the preparation of organo N-hydroxyimidates ALLIED CORPORATION (US) 1988-05-10 US disclosed
EP-0035291-B1 PROCESS FOR CARRYING OUT RADICAL REACTIONS AND SHAPED ARTICLES OF THE REACTION PRODUCT AKZO N.V. (NL) 1983-05-11 EP disclosed
US-4374938-A HYDROXIMIC ACID DERIVATIVE AS FREE RADICAL INITIATOR AKZONA INCORPORATED (US) 1983-02-22 US disclosed
US-4347342-A Process for initiating radical reactions employing hydroximic acid derivatives AKZONA INCORPORATED (US) 1982-08-31 US disclosed
EP-0035291-A1 Process for carrying out radical reactions and shaped articles of the reaction product AKZO N.V. (NL) 1981-09-09 EP disclosed