SCHEMBL7445879

SCHEMBL7445879

c1ccc(COC2CCCO2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 3/20 0.47
KDM4C Q9H3R0 1/20 0.42
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
EP300 Q09472 1/20 0.40
CREBBP Q92793 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CTSK P43235 1/20 0.39
CCR5 P51681 1/20 0.39
CYP1A2 P05177 1/20 0.39
TSHR P16473 1/20 0.39
DPP4 P27487 1/20 0.39

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
SCHEMBL4184332 0.95 KDM4C (0.47) TACR1KDM4CPSEN1PSEN2APH1B
SCHEMBL11258174 0.93 KDM4C (0.46) TACR1KDM4CEP300CREBBPMEN1
SCHEMBL2571382 0.91 TSHR (0.43) TACR1PSEN1PSEN2APH1BNCSTN
SCHEMBL26651890 0.84 MEN1 (0.49) TACR1KDM4CMEN1KMT2ATSHR
SCHEMBL31120346 0.83 KMT2A (0.47) TACR1KMT2AALDH1A1
SCHEMBL31120281 0.83 TACR1 (0.42) TACR1TSHR
SCHEMBL92954 0.82 NAAA (0.47) TACR1KDM4CEP300CREBBPMEN1
SCHEMBL24765047 0.81 KDM4C (0.45) TACR1KDM4CEP300CREBBPMEN1
SCHEMBL20233781 0.81 KDM4C (0.45) TACR1KDM4CEP300CREBBPMEN1
SCHEMBL31419831 0.80 MEN1 (0.51) KDM4CMEN1KMT2A

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-119241479-A Method for synthesizing acetal compound by light promotion 河南大学 2025-01-03 CN disclosed
CN-118724845-A Method for preparing ether derivatives by low-cost metal catalysis 哈尔滨工业大学(深圳)(哈尔滨工业大学深圳科技创新研究院) 2024-10-01 CN disclosed
WO-2017035355-A1 ETHER COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-02 WO disclosed
US-5621133-A PREPARING A 1-(3,4-DIALKOXYPHENYL),3-HYDROXYALKANE(C6-C12) BY EPOXIDIZING A HALO DERIVATIVE WITH A BASE FOLLOWED BY DECYCLICIZING WITH AN ORGANOMETALLIC COMPOUND IN A SOLVENT; NAPHTHYLENES, ISOCHROMENES AND ISOTHIOCHROMENES DENINNO MICHAEL P (US) 1997-04-15 US disclosed
US-5591884-A PROTECTED HYDROXYALKYLCATECHOL INTERMEDIATES ABBOTT LABORATORIES (US) 1997-01-07 US disclosed
WO-1996038435-A1 DOPAMINE AGONISTS ABBOTT LABORATORIES (US) 1996-12-05 WO disclosed
EP-0474767-B1 DOPAMINE AGONISTS ABBOTT LAB (US) 1996-02-21 EP disclosed
EP-0474767-A4 DOPAMINE AGONISTS 1992-07-08 EP disclosed
EP-0474767-A1 DOPAMINE AGONISTS. ABBOTT LAB (US) 1992-03-18 EP disclosed
WO-1990015056-A1 DOPAMINE AGONISTS ABBOTT LABORATORIES (US) 1990-12-13 WO disclosed
US-4447605-A Di(tri-lower alkylstannyl)pyrimidine derivative and a process for producing the same RIKAGAKU KENKYUSHO (JP) 1984-05-08 US disclosed
US-4324895-A REACTION BETWEEN BIS(TRI-LOWER ALKYLSTANNYL)-5-HALOGENOURACIL AND 2-SUBSTITUTED TETRAHYDROFURAN RIKAGAKU KENKYUSHO (JP) 1982-04-13 US disclosed
US-4059596-A BACTERICIDE, FUNGICIDE, SPORICIDE STERLING DRUG INC. (US) 1977-11-22 US disclosed