SCHEMBL17755

SCHEMBL17755

O=C(c1ccc(O)cc1)c1cc(Br)ccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
MAPT P10636 6/20 0.49
MAPK1 P28482 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
POLB P06746 1/20 0.47
HPGD P15428 4/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
ALOX15 P16050 1/20 0.47
CASP1 P29466 1/20 0.47
CYP2C19 P33261 1/20 0.47
LMNA P02545 2/20 0.47
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
PKM P14618 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
SCHEMBL30482609 1.00 ALDH1A1 (0.51) ALDH1A1CASP3SENP8SENP7SENP6
SCHEMBL3468181 0.86 SRD5A2 (0.50) ALDH1A1CASP3SENP8SENP7SENP6
SCHEMBL29740498 0.85 ALDH1A1 (0.50) ALDH1A1MAPTPOLBHPGDCYP1A2
SCHEMBL1457582 0.85 ALDH1A1 (0.50) ALDH1A1MAPTKMT2APOLBHPGD
SCHEMBL2637828 0.85 ALDH1A1 (0.50) ALDH1A1MAPTPOLBHPGDCYP1A2
SCHEMBL499767 0.85 MAPT (0.67) ALDH1A1MAPTMAPK1KMT2APOLB
SCHEMBL27751160 0.84 MAPT (0.67) ALDH1A1MAPTMAPK1POLBHPGD
SCHEMBL612249 0.82 MAPK1 (0.62) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL499583 0.82 ALDH1A1 (0.47) ALDH1A1MAPTPOLBHPGDCYP1A2
SCHEMBL6442538 0.81 ALDH1A1 (0.46) ALDH1A1MAPTMAPK1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118619823-A Preparation method of 4-bromo-1-chloro-2- (4- (2-cyclopropyloxy ethoxy) benzyl) benzene 杭州科巢生物科技有限公司 2024-09-10 CN claimed
CN-116354799-A Preparation method of dapagliflozin intermediate 江苏阿尔法药业股份有限公司 2023-06-30 CN claimed
CN-116262690-A Synthesis method of (5-bromo-2-chlorophenyl) (4-ethoxyphenyl) methanone 苏州小栗医药科技有限公司 2023-06-16 CN claimed
CN-118619823-A Preparation method of 4-bromo-1-chloro-2- (4- (2-cyclopropyloxy ethoxy) benzyl) benzene 杭州科巢生物科技有限公司 2024-09-10 CN disclosed
CN-116354799-A Preparation method of dapagliflozin intermediate 江苏阿尔法药业股份有限公司 2023-06-30 CN disclosed
CN-116354799-A Preparation method of dapagliflozin intermediate 江苏阿尔法药业股份有限公司 2023-06-30 CN disclosed
CN-116262690-A Synthesis method of (5-bromo-2-chlorophenyl) (4-ethoxyphenyl) methanone 苏州小栗医药科技有限公司 2023-06-16 CN disclosed
EP-2703396-B1 INHIBITOR OF SODIUM-DEPENDENT GLUCOSE TRANSPORT PROTEIN AND PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING PRELUDE PHARM SCI & TECH CO LTD (CN) 2016-06-22 EP disclosed
EP-2703396-B1 INHIBITOR OF SODIUM-DEPENDENT GLUCOSE TRANSPORT PROTEIN AND PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING PRELUDE PHARM SCI & TECH CO LTD (CN) 2016-06-22 EP disclosed
US-8957033-B2 Inhibitor of sodium-dependent glucose transport protein and preparation method therefor and use thereof BEIJING PRELUDE PHARM. SCI. & TECH. CO., LTD. (CN) 2015-02-17 US disclosed
US-8957033-B2 Inhibitor of sodium-dependent glucose transport protein and preparation method therefor and use thereof BEIJING PRELUDE PHARM. SCI. & TECH. CO., LTD. (CN) 2015-02-17 US disclosed
US-8957033-B2 Inhibitor of sodium-dependent glucose transport protein and preparation method therefor and use thereof BEIJING PRELUDE PHARM. SCI. & TECH. CO., LTD. (CN) 2015-02-17 US disclosed
EP-2703396-A1 INHIBITOR OF SODIUM-DEPENDENT GLUCOSE TRANSPORT PROTEIN AND PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Prelude Pharm. Sci.& Tech. Co., Ltd. (CN) 2014-03-05 EP disclosed
EP-2703396-A1 INHIBITOR OF SODIUM-DEPENDENT GLUCOSE TRANSPORT PROTEIN AND PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Prelude Pharm. Sci.& Tech. Co., Ltd. (CN) 2014-03-05 EP disclosed
US-20140051648-A1 Inhibitor of Sodium-Dependent Glucose Transport Protein and Preparation Method Therefor and Use Thereof BEIJING PRELUDE PHARM. SCI. & TECH. CO., LTD. (CN) 2014-02-20 US disclosed
US-20140051648-A1 Inhibitor of Sodium-Dependent Glucose Transport Protein and Preparation Method Therefor and Use Thereof BEIJING PRELUDE PHARM. SCI. & TECH. CO., LTD. (CN) 2014-02-20 US disclosed
US-20140051648-A1 Inhibitor of Sodium-Dependent Glucose Transport Protein and Preparation Method Therefor and Use Thereof BEIJING PRELUDE PHARM. SCI. & TECH. CO., LTD. (CN) 2014-02-20 US disclosed
WO-2012025857-A1 CYCLOALKYL METHOXYBENZYL PHENYL PYRAN DERIVATIVES AS SODIUM DEPENDENT GLUCOSE CO TRANSPORTER (SGLT2) INHIBITORS HETERO RESEARCH FOUNDATION (IN) 2012-03-01 WO disclosed
WO-2012025857-A1 CYCLOALKYL METHOXYBENZYL PHENYL PYRAN DERIVATIVES AS SODIUM DEPENDENT GLUCOSE CO TRANSPORTER (SGLT2) INHIBITORS HETERO RESEARCH FOUNDATION (IN) 2012-03-01 WO 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 (1 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-20140051648-A1 Inhibitor of Sodium-Dependent Glucose Transport Protein and Preparation Method Therefor and Use Thereof SLC5A1, SLC5A2, SLC2A1 ALDH1A1 1948/4885CASP3 3483/4885SENP8 2386/4885

“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.