SCHEMBL6072641

SCHEMBL6072641

CC(C)Cc1ccccc1C(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.50
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
CYP19A1 P11511 1/20 0.47
GABRA1 P14867 1/20 0.46
GABRB2 P47870 1/20 0.46
BCL2 P10415 1/20 0.45
MCL1 Q07820 1/20 0.45
ALDH1A1 P00352 4/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 2/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ELANE P08246 1/20 0.44
KMT2A Q03164 1/20 0.42
CAPN1 P07384 1/20 0.42

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
SCHEMBL2257068 0.89 GABRA1 (0.52) GAAMAPTGABRA1GABRB2ALDH1A1
SCHEMBL27657200 0.88 AKR1C3 (0.48) AKR1C3GAAMAPTCYP19A1BCL2
SCHEMBL2257072 0.87 AKR1C3 (0.44) AKR1C3GAAMAPTCYP19A1GABRA1
SCHEMBL28460329 0.87 GABRA1 (0.58) AKR1C3GAAMAPTGABRA1GABRB2
SCHEMBL19285676 0.86 GAA (0.49) AKR1C3GAAMAPTCYP19A1BCL2
SCHEMBL19834618 0.85 AKR1C3 (0.43) AKR1C3GAAMAPTCYP19A1GABRA1
SCHEMBL31676651 0.84 AKR1C3 (0.52) AKR1C3GAAMAPTCYP19A1ALDH1A1
SCHEMBL157592 0.83 FOLH1 (0.53) MAPTGABRA1GABRB2ALDH1A1HPGD
SCHEMBL9067076 0.83 AKR1C3 (0.47) AKR1C3GAAMAPTCYP19A1BCL2
SCHEMBL2867843 0.82 AKR1C3 (0.43) AKR1C3GAAMAPTCYP19A1BCL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107629572-B Oily teflon non-stick coating and preparation method thereof 金华大荣涂料有限公司 2020-07-10 CN claimed
CN-112939915-B Diamine monomer for photosensitive resin, polyimide precursor, photosensitive resin composition, and use thereof 武汉柔显科技股份有限公司 2022-10-14 CN disclosed
WO-2022107692-A1 SEALING MATERIAL FOR ORGANIC EL DISPLAY ELEMENT, CURED PRODUCT OF SAID SEALING MATERIAL, AND ORGANIC EL DISPLAY DEVICE 三井化学株式会社 2022-05-27 WO disclosed
CN-108218707-B Tetra-substituted olefin and preparation method thereof 南京农业大学 2021-02-02 CN disclosed
CN-110494414-A α-functionalization ketone preparation method IGM GROUP BV 2019-11-22 CN disclosed
CN-101371304-B Optical recording medium MITSUBISHI KAGAKU MEDIA CO LTD 2011-09-14 CN disclosed
CN-101371304-A Optical recording medium MITSUBISHI KAGAKU MEDIA CO LTD (JP) 2009-02-18 CN disclosed
CN-1900208-A Refrigerant compositions containing a compatibilizer DU PONT (US) 2007-01-24 CN disclosed
WO-2006022731-A1 REUSABLE FRIEDEL-CRAFTS CATALYSTS, THEIR USE, AND THEIR REGENERATION ALBEMARLE CORPORATION (US) 2006-03-02 WO disclosed
CN-1555365-A N-aminoimidazole derivative for inhibiting HIV ³�������̴�ѧ�о������� 2004-12-15 CN disclosed
CN-1479772-A Refrigerant compositions comprising compatibilizers ��Ļ���Ű˾ 2004-03-03 CN disclosed