SCHEMBL316799

SCHEMBL316799

C[C@H](O)c1ccccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.55
ADRB1 P08588 2/20 0.55
AOC3 Q16853 1/20 0.50
CYP2D6 P10635 2/20 0.48
NFKB1 P19838 2/20 0.48
HIF1A Q16665 2/20 0.48
BLM P54132 1/20 0.47
PDE2A O00408 1/20 0.47
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
PNMT P11086 1/20 0.45
NISCH Q9Y2I1 1/20 0.44
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
GLA P06280 1/20 0.43
TSHR P16473 2/20 0.43
ACP3 P15309 1/20 0.42
CASP1 P29466 1/20 0.42
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41

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
SCHEMBL15943179 1.00 ADRB2 (0.55) ADRB2ADRB1AOC3CYP2D6NFKB1
SCHEMBL504837 1.00 ADRB2 (0.55) ADRB2ADRB1AOC3CYP2D6NFKB1
SCHEMBL342944 1.00 ADRB2 (0.55) ADRB2ADRB1AOC3CYP2D6NFKB1
SCHEMBL29633572 1.00 ADRB2 (0.55) ADRB2ADRB1AOC3CYP2D6NFKB1
SCHEMBL11743000 0.88 ADRB2 (0.46) ADRB2ADRB1AOC3CYP2D6NFKB1
SCHEMBL11606505 0.81 TSHR (0.50) ADRB2ADRB1AOC3CYP2D6NFKB1
SCHEMBL253300 0.81 ADRB2 (0.52) ADRB2ADRB1AOC3CYP2D6NFKB1
SCHEMBL253784 0.81 ADRB2 (0.52) ADRB2ADRB1AOC3CYP2D6NFKB1
SCHEMBL253722 0.81 ADRB2 (0.52) ADRB2ADRB1AOC3CYP2D6NFKB1
SCHEMBL253301 0.81 ADRB2 (0.52) ADRB2ADRB1AOC3CYP2D6NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108410830-B Ketoreductase and method for preparing (S) -1- (2-chlorphenyl) ethanol by catalyzing ketoreductase 尚科生物医药(上海)有限公司 2021-06-25 CN claimed
WO-2025096957-A1 RAS-PI3K INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. (US) 2025-05-08 WO disclosed
US-12281058-B2 Manganese catalysts and their use in hydrogenation of ketones UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2025-04-22 US disclosed
CN-119776301-A Alcohol dehydrogenase, recombinant genetically engineered bacterium and application thereof in asymmetric reduction of potential chiral carbonyl compounds 杭州文德阶生物科技有限公司 2025-04-08 CN disclosed
US-20240174683-A1 MAP4K1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2024-05-30 US disclosed
EP-4288437-A1 MAP4K1 INHIBITORS Bayer Aktiengesellschaft (DE) 2023-12-13 EP disclosed
CN-113846082-B Halohydrin dehalogenase mutant, encoding gene, recombinant vector, recombinant genetic engineering bacteria and application thereof 华东理工大学 2023-06-23 CN disclosed
CN-115209993-A Catalyst comprising activated carbon having ruthenium complex adsorbed thereon and method for producing reduced product using same 高砂香料工业株式会社 2022-10-18 CN disclosed
US-11427552-B2 Heterocyclic compounds useful in the treatment of disease EPIGEN BIOSCIENCES, INC. (US) 2022-08-30 US disclosed
WO-2022167627-A1 MAP4K1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2022-08-11 WO disclosed
WO-2007030359-A1 BENZIMIDAZOLE THIOPHENE COMPOUNDS AS PLK MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2007-03-15 WO disclosed
EP-1747224-A1 COMPLEXES OF RUTHENIUM WITH 2-(AMINOMETHYL)PYRIDINES AND PHOSPHINES, THEIR PREPARATION AND USE AS CATALYSTS Universita' Degli Studi di Udine (IT) 2007-01-31 EP disclosed
US-20060035885-A1 8-Substituted-6,7,8,9-tetrahydropyrimido [1,2-a] pyrimidin-4-one derivatives SANOFI-AVENTIS (FR) 2006-02-16 US disclosed
EP-1608654-A2 8-SUBSTITUTED-6, 7, 8,9-TETRAHY9DROPYRIMIDO (1,2- a) PYRIMIDIN-4-ONE DERIVATIVES Sanofi-Aventis (FR) 2005-12-28 EP disclosed
WO-2005105819-A1 COMPLEXES OF RUTHENIUM WITH 2-(AMINOMETHYL)PYRIDINES AND PHOSPHINES, THEIR PREPARATION AND USE AS CATALYSTS UNIVERSITA' DEGLI STUDI DI UDINE (IT) 2005-11-10 WO disclosed
CN-1174103-C Process for preparing chiral substituted arylepoxyethane compounds and its biol by selective splitting of Aspergillus niger 中国科学院上海有机化学研究所 2004-11-03 CN disclosed
WO-2004082577-A2 8-SUBSTITUTED-6, 7, 8, 9-TETRAHYDROPYRIMIDO[1,2-a] PYRIMIDIN-4-ONE DERIVATIVES SANOFI-AVENTIS (FR) 2004-09-30 WO disclosed
WO-2002069895-A2 HETEROCYCLIC ANALGESIC COMPOUNDS AND METHODS OF USE THEREOF SEPRACOR, INC. (US) 2002-09-12 WO disclosed
EP-0198440-B1 PROCESS FOR PREPARING OPTICALLY ACTIVE 2-HALO-1-PHENYL ETHANOL KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1992-08-26 EP disclosed
US-4857468-A BIOSYNTHESIS KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-08-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12281058-B2 Manganese catalysts and their use in hydrogenation of ketones CYC1, SCO2, MT-CO3 ADRB2 2518/4885ADRB1 2746/4885AOC3 91/4885
US-20240174683-A1 MAP4K1 INHIBITORS MAP3K4, MAP4K4, MAP4K1 ADRB2 3213/4885ADRB1 2123/4885AOC3 4395/4885
US-11427552-B2 Heterocyclic compounds useful in the treatment of disease LPAR1, LPAR4, LPAR3 ADRB2 357/4885ADRB1 247/4885AOC3 1647/4885
US-20060035885-A1 8-Substituted-6,7,8,9-tetrahydropyrimido [1,2-a] pyrimidin-4-one derivatives GSK3A, PSEN1, GSK3B ADRB2 1284/4885ADRB1 644/4885AOC3 3463/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.