SCHEMBL7972936

SCHEMBL7972936

CNC(=O)C(=O)c1ccccc1COC1CCCCO1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 2/20 0.41
EP300 Q09472 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HPGD P15428 3/20 0.36
HSD17B10 Q99714 1/20 0.36
SLC6A3 Q01959 2/20 0.36
LMNA P02545 2/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ICAM1 P05362 1/20 0.35
SELE P16581 1/20 0.35
KAT2B Q92831 1/20 0.35
BAZ2B Q9UIF8 1/20 0.35

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
SCHEMBL7975649 0.85 MEN1 (0.44) CREBBPEP300MEN1KMT2AALDH1A1
SCHEMBL8102878 0.85 HIF1A (0.40) CREBBPEP300MEN1KMT2AALDH1A1
SCHEMBL4322060 0.84 MEN1 (0.50) CREBBPEP300MEN1KMT2AALDH1A1
SCHEMBL7959257 0.83 KDM4E (0.40) CREBBPEP300MEN1KMT2AALDH1A1
SCHEMBL7452571 0.82 ICAM1 (0.44) CREBBPEP300MEN1KMT2AALDH1A1
SCHEMBL27435640 0.78 CREBBP (0.41) CREBBPEP300MEN1KMT2AALDH1A1
SCHEMBL17909890 0.77 KDM4C (0.38) CREBBPEP300MEN1KMT2AALDH1A1
SCHEMBL22071054 0.76 MRGPRX4 (0.45) CREBBPEP300MEN1KMT2AALDH1A1
SCHEMBL18355699 0.76 TACR1 (0.46) CREBBPEP300MEN1KMT2ARAB9A
SCHEMBL1189675 0.75 PRMT5 (0.41) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1176918-C Alpha-substituted benzene acetic acid its preparation and farm pesticide containing said compound ��Ұ����ҩ��ʽ���� 2004-11-24 CN disclosed
CN-1105703-C Alpha-substituted phenylacetic acid derivatives, their preparation and agricultural fungicides containing the same SHIONOGI & CO (JP) 2003-04-16 CN disclosed
CN-1082046-C Process for producing 2- (2-hydroxymethylphenyl) acetamide derivative and intermediate for production thereof SHIONOGI & CO (JP) 2002-04-03 CN disclosed
US-6313150-B1 FOR CONTROLLING PHYTOPATHOGENIC FUNGI SHIONOGI & CO., LTD. (JP) 2001-11-06 US disclosed
US-6147231-A Process for producing 2(2-hydroxymethylphenyl)acetamide derivative and intermediate for the production thereof SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed
EP-0754672-B1 GAMMA-SUBSTITUTED PHENYLACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND AGRICULTURAL BACTERICIDE CONTAINING THE SAME SHIONOGI & CO (JP) 2000-10-11 EP disclosed
EP-0801054-B1 PROCESS FOR PRODUCING 2-(2-HYDROXYMETHYLPHENYL)ACETAMIDE DERIVATIVE AND INTERMEDIATE FOR THE PRODUCTION THEREOF SHIONOGI & CO (JP) 2000-05-24 EP disclosed
US-5948819-A α-substituted phenylacetic acid derivative, its production and agricultural fungicide containing it SHIONOGI & CO., LTD (JP) 1999-09-07 US disclosed
CN-1175244-A Process for producing 2- (2-hydroxymethylphenyl) acetamide derivative and intermediate for production thereof SHIONOGI & CO (JP) 1998-03-04 CN disclosed
EP-0801054-A1 PROCESS FOR PRODUCING 2-(2-HYDROXYMETHYLPHENYL)ACETAMIDE DERIVATIVE AND INTERMEDIATE FOR THE PRODUCTION THEREOF SHIONOGI & CO., LTD. (JP) 1997-10-15 EP disclosed
CN-1145061-A Alpha-substituted phenylacetic acid derivatives, their preparation and agricultural fungicides containing the same SHIONOGI & CO (JP) 1997-03-12 CN disclosed
EP-0754672-A1 GAMMA-SUBSTITUTED PHENYLACETIC ACID DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND AGRICULTURAL BACTERICIDE CONTAINING THE SAME SHIONOGI & CO., LTD. (JP) 1997-01-22 EP disclosed