SCHEMBL8166205

SCHEMBL8166205

CC(C(=O)Oc1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 4/20 0.51
▸ HDAC3 O15379 1/20 0.50
▸ HDAC4 P56524 1/20 0.50
▸ HDAC1 Q13547 1/20 0.50
▸ HDAC7 Q8WUI4 1/20 0.50
▸ HDAC2 Q92769 1/20 0.50
▸ HDAC10 Q969S8 1/20 0.50
▸ HDAC11 Q96DB2 1/20 0.50
▸ HDAC8 Q9BY41 1/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.50
▸ HDAC9 Q9UKV0 1/20 0.50
▸ HDAC5 Q9UQL6 1/20 0.50
▸ CHRM2 P08172 8/20 0.49
▸ CHRM4 P08173 6/20 0.49
▸ CHRM1 P11229 6/20 0.49
▸ CHRM3 P20309 6/20 0.49
▸ CHRM5 P08912 5/20 0.49
▸ BCHE P06276 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ MAPT P10636 1/20 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
SCHEMBL28470478 0.90 HDAC3 (0.46) ELANEHDAC3HDAC4HDAC1HDAC7
SCHEMBL27479898 0.84 ALDH1A1 (0.50) CHRM2BCHEMAPT
SCHEMBL4954674 0.84 MAPT (0.53) ELANEL3MBTL1MAPTTDP1ATM
SCHEMBL28003881 0.84 ELANE (0.51) ELANEL3MBTL1MAPTTDP1ATM
SCHEMBL28201057 0.82 ELANE (0.50) ELANEL3MBTL1MAPTTDP1ATM
SCHEMBL27634804 0.82 ELANE (0.50) ELANEL3MBTL1MAPTTDP1ATM
SCHEMBL27836797 0.82 ELANE (0.50) ELANEL3MBTL1MAPTTDP1ATM
SCHEMBL2342588 0.81 ELANE (0.72) ELANEL3MBTL1TDP1ATM
SCHEMBL17681401 0.81 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL27453850 0.81 ELANE (0.50) ELANEL3MBTL1MAPTTDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107004912-A Electrolyte and metal hydride battery 巴斯夫公司 2017-08-01 — — CN disclosed
CN-1310872-C Mono- and disubstituted 3-propyl gamma-aminobutyric acids WARNER LAMBERT CO (US) 2007-04-18 — — CN disclosed
CN-1660779-A Mono- and disubstituted 3-propyl gamma-aminobutyric acids WARNER LAMBERT CO (US) 2005-08-31 — — CN disclosed
CN-1196671-C Mono-and disubstituted 3-propyl-gamma-aminobutyric acids WARNER LAMBERT CO (US) 2005-04-13 — — CN disclosed
CN-1355784-A Mono-and disubstituted 3-propyl-gamma-aminobutyric acids WARNER LAMBERT CO (US) 2002-06-26 — — CN disclosed
CN-1075808-C Aniline derivatives having nitric oxide synthase inhibitory activity CHUGAI PHARMACEUTICAL CO LTD (JP) 2001-12-05 — — CN disclosed
CN-1306422-A Substituted diphenyl indanone, indane and indole compounds and analogs thereof for the treatment or prevention of diseases characterized by abnormal cell proliferation HARVARD COLLEGE (US) 2001-08-01 — — CN disclosed
US-6096464-A CHARGE TRANSPORT LAYER INCLUDES A CHARGE TRANSPORT MATERIAL AND A ROTAXANE MATERIAL; PHOTORECEPTORS HAVE EXCELLENT XEROGRAPHIC PROPERTIES SUCH AS HIGH PHOTOSENSITIVITY AND LOW RESIDUAL VOLTAGE AND IMPROVED ABRASION RESISTANCE XEROX CORPORATION (US) 2000-08-01 — — US disclosed
CN-1251037-A Triarylmethane compounds for sickle cell disease HARVARD COLLEGE (US) 2000-04-19 — — CN disclosed
US-5248746-A Cationic polymerization, molecular weight control NIPPON ZEON CO., LTD. (JP) 1993-09-28 — — US disclosed
CN-1019969-C synthesis method of conjugated carboxylic alkenoic acid SHIONOGI & CO (JP) 1993-03-03 — — CN disclosed
EP-0451679-A2 Method of producing polymers NIPPON ZEON CO., LTD. (JP) 1991-10-16 — — EP disclosed
CN-85101417-A Method for synthesizing acrylic acid — 1987-01-10 — — CN disclosed
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