SCHEMBL27459727

SCHEMBL27459727

CCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C(Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR5A2 O00482 1/20 0.46
NR5A1 Q13285 1/20 0.46
ESR1 P03372 4/20 0.40
AKR1C4 P17516 1/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
AKR1C1 Q04828 1/20 0.40
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
RXRA P19793 2/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
PPARG P37231 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
SCHEMBL28948169 0.95 NR5A2 (0.47) NR5A2NR5A1ESR1AKR1C4AKR1C3
SCHEMBL3679812 0.95 NR5A2 (0.47) NR5A2NR5A1ESR1AKR1C4AKR1C3
SCHEMBL30021174 0.95 NR5A2 (0.47) NR5A2NR5A1ESR1AKR1C4AKR1C3
SCHEMBL28315152 0.84 HSPA5 (0.43) NR5A2NR5A1ESR1AKR1C4AKR1C3
SCHEMBL28527438 0.84 HSPA5 (0.47) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL28078971 0.84 NR5A2 (0.44) NR5A2NR5A1CYP1A2CYP3A4CYP2C9
SCHEMBL7649243 0.83 CYP2C19 (0.39) NR5A2NR5A1CYP1A2CYP3A4CYP2C9
SCHEMBL29357716 0.81 NR5A2 (0.44) NR5A2NR5A1ESR1AKR1C4AKR1C3
SCHEMBL29373469 0.81 NR5A2 (0.44) NR5A2NR5A1ESR1AKR1C4AKR1C3
SCHEMBL39473 0.81 NR5A2 (0.44) NR5A2NR5A1ESR1AKR1C4AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1272369-C Stabilizing agent coposition for chlorine-containing polymer CROMPTON VINYL ADDITIVES GMBH (DE) 2006-08-30 CN disclosed
CN-1271134-C Stabilizing agent composition for chlorine-containing polymer KROMPTON ETHYLENT ADDITIVE GMB (DE) 2006-08-23 CN disclosed
CN-1271133-C Stabilizing agent composition for chlorine-containing polymer KROMPTON ETHYLENE ADDITIVE GMB (DE) 2006-08-23 CN disclosed
CN-1259362-C Stabilizing agent copmosition for chlorine-containing polymer KROMPTON ETHYLENE ADDITIVE GMB (DE) 2006-06-14 CN disclosed
CN-1234762-C Stabilizing agent composition for chlorine-containing polymer KROMPTON ETHYLENE ADDITIVE GMB (DE) 2006-01-04 CN disclosed
CN-1231529-C Stabilizing agent composition for chlorine-containing polymer KROMPTON ETHYLENE ADDITIVE GMB (DE) 2005-12-14 CN disclosed
CN-1515614-A Stabilizing agent composition for chlorine-containing polymer ����ķ�ն���ϩ��Ӽ����޹�˾ 2004-07-28 CN disclosed
CN-1515612-A Stabilizing agent composition for chlorine-containing polymer ����ķ�ն���ϩ��Ӽ����޹�˾ 2004-07-28 CN disclosed
CN-1515611-A Stabilizing agent composition for chlorine-containing polymer ����ķ�ն���ϩ��Ӽ����޹�˾ 2004-07-28 CN disclosed
CN-1515610-A Stabilizing agent copmosition for chlorine-containing polymer ����ķ�ն���ϩ��Ӽ����޹�˾ 2004-07-28 CN disclosed
CN-1515616-A Stabilizing agent composition for chlorine-containing polymer ����ķ�ն���ϩ��Ӽ����޹�˾ 2004-07-28 CN disclosed
CN-1515609-A Stabilizing agent coposition for chlorine-containing polymer ����ķ�ն���ϩ��Ӽ����޹�˾ 2004-07-28 CN disclosed
CN-1515613-A Stabilizing agent composition for chlorine-containing polymer ����ķ�ն���ϩ��Ӽ����޹�˾ 2004-07-28 CN disclosed
CN-1122684-C stabilizer composition for chlorine-containing polymers KROMUPUTON ETHYLENE ADDITIVES (DE) 2003-10-01 CN disclosed
CN-1154381-A stabilizer composition for chlorine-containing polymers CIBA GEIGY AG (CH) 1997-07-16 CN disclosed