SCHEMBL2645083

SCHEMBL2645083

O=C(CCO)N1CCCC1

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.68
ALDH1A1 P00352 5/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
L3MBTL1 Q9Y468 2/20 0.56
TDP1 Q9NUW8 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
NPC1 O15118 2/20 0.48
HPGD P15428 3/20 0.48
KDM4E B2RXH2 1/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 1/20 0.48
HSD17B10 Q99714 1/20 0.48
GAA P10253 1/20 0.44
RAB9A P51151 1/20 0.44
NAAA Q02083 1/20 0.43

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
SCHEMBL5303517 0.97 ATM (0.65) ATMALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL9723662 0.89
SCHEMBL6043558 0.85 ATM (0.77) ATMALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL6043707 0.83 ATM (0.74) ATMALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL3004492 0.83 ATM (0.74) ATMALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL9353827 0.81 ATM (0.71) ATMALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL6043908 0.81 ATM (0.71) ATMALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL19244611 0.80 ATM (0.68) ATMALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL14041701 0.79 ATM (0.68) ATMALDH1A1SMN1; SMN2L3MBTL1TDP1
SCHEMBL5518648 0.79 ATM (0.68) ATMALDH1A1SMN1; SMN2L3MBTL1TDP1

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3882248-A1 DIMETHOXYBENZENE COMPOUND ANALOGS, METHODS FOR ANALYZING SAID COMPOUNDS AND STANDARD PRODUCTS OF SAID COMPOUNDS Taiho Pharmaceutical Co., Ltd. (JP) 2021-09-22 EP disclosed
CN-109640999-A Combination treatment 无限药品股份有限公司 2019-04-16 CN disclosed
CN-109381451-A Magnesium threonate and combinations thereof for treating tumour 无锡脑镁素生物医药科技有限公司 2019-02-26 CN disclosed
CN-104703979-B Heterocyclic compounds and their use 无限药品股份有限公司 2018-11-27 CN disclosed
CN-108864102-A ERK inhibitor and application method 库拉肿瘤学公司 2018-11-23 CN disclosed
CN-105793255-B Heterocyclic compounds and their use 无限药品股份有限公司 2018-11-16 CN disclosed
CN-108138023-A Polyurethane adhesive layer for electro-optical assemblies 伊英克公司 2018-06-08 CN disclosed
CN-107708693-A Metal-chelator of Metabolic programming and application thereof 佛罗里达大学研究基金会 2018-02-16 CN disclosed
CN-103764632-B Co-crystals of cyprodinil and dithianon 巴斯夫欧洲公司 2017-05-17 CN disclosed
CN-106619647-A Combinations of kinase inhibitors and uses thereof 因特利凯有限责任公司 2017-05-10 CN disclosed
WO-2003103652-A1 METHODS OF TREATING ALZHEIMER’S DISEASE USING AROMATICALLY SUBSTITUTED ω-AMINO-ALKANOIC ACID AMIDES AND ALKANOIC ACID DIAMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed
US-6232273-B1 MACROMOLECULAR COMPOUND WITH NITROGEN-CONTAINING RING PENDANT TO THE POLYMER CHAIN, SUCH AS POLYMER OF (METH)ACRYLOYL PYRROLIDINE, PYRROLIDINOCARBONYLETHYL (METH)ACRYLATE, 2-OXO-PYRROLIDINO-ETHYL (METH)ACRYLATE, ETC. NIPPON SHOKUBAI CO., LTD. (JP) 2001-05-15 US disclosed
US-5958837-A 2-(PHENYLMETHOXY OR CARBONYLOXY-(1,4-PHENYLENE)-),3-HALO,5-HALOALKYLPYRIDINES; HERBICIDES EFFECTING DESICCATION AND DEFOLIATION OF PLANTS; GOOD ACTIVITY AND BETTER TAILORED CONTROL OF WEEDS BASF AKTIENGESELLSCHAFT (DE) 1999-09-28 US disclosed
EP-0802904-B1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AG (DE) 1998-09-09 EP disclosed
EP-0828778-A1 CLATHRATE HYDRATE INHIBITOR AND METHOD OF INHIBITING THE FORMATION OF CLATHRATE HYDRATES USING IT NIPPON SHOKUBAI CO., LTD. (JP) 1998-03-18 EP disclosed
EP-0802904-A1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-10-29 EP disclosed
US-5641778-A EXHIBIT RENIN-INHIBITING PROPERTIES AND CAN BE USED AS ANTIHYPERTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-06-24 US disclosed
WO-1996038492-A1 CLATHRATE HYDRATE INHIBITOR AND METHOD OF INHIBITING THE FORMATION OF CLATHRATE HYDRATES USING IT NIPPON SHOKUBAI CO., LTD. (JP) 1996-12-05 WO disclosed
WO-1996021647-A1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-07-18 WO disclosed
EP-0716077-A1 Aromatically substituted omega amino alcanoic acid amides and alcanoic diamides and their use as renine inhibitors CIBA-GEIGY AG (CH) 1996-06-12 EP disclosed