SCHEMBL19979062

SCHEMBL19979062

Cc1c(Cl)cccc1OC(=O)Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.47
ALDH1A1 P00352 4/20 0.42
MAPT P10636 4/20 0.42
ACHE P22303 1/20 0.42
LMNA P02545 3/20 0.39
POLB P06746 2/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
MT-CO2 P00403 1/20 0.39
TTR P02766 1/20 0.39
PLA2G1B P04054 1/20 0.39
CYP1A2 P05177 1/20 0.39
PGR P06401 1/20 0.39
CYP3A4 P08684 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
AR P10275 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 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
SCHEMBL21728175 0.85 ACHE (0.59) MRGPRX4ALDH1A1MAPTACHELMNA
SCHEMBL31285761 0.83 MRGPRX4 (0.46) MRGPRX4ALDH1A1MAPTACHELMNA
SCHEMBL8463126 0.82 POLB (0.56) ALDH1A1MAPTACHELMNAPOLB
SCHEMBL24309423 0.81 HPGD (0.50) MRGPRX4ALDH1A1MAPTACHELMNA
SCHEMBL19979061 0.80 MRGPRX4 (0.43) MRGPRX4ALDH1A1MAPTACHELMNA
SCHEMBL27952004 0.80 MRGPRX4 (0.47) MRGPRX4ALDH1A1MAPTACHELMNA
SCHEMBL3918667 0.80 TSHR (0.45) MRGPRX4ALDH1A1MEN1CYP1A2CYP3A4
SCHEMBL695666 0.79 PTK2B (0.50) ALDH1A1MAPTLMNAPOLBMEN1
SCHEMBL11285158 0.78 MRGPRX4 (0.45) MRGPRX4ALDH1A1LMNAPOLBMEN1
SCHEMBL27698905 0.76 MAPK1 (0.44) MRGPRX4ALDH1A1MAPTLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107406374-B Process for preparing 3-chloro-2-vinylphenyl sulfonate 拜耳作物科学股份公司 2020-07-14 CN disclosed
US-10618872-B2 Process for preparing 3-chloro-2-vinylphenylsulfonates BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-04-14 US disclosed
EP-3265439-B1 PROCESS FOR PREPARING 3-CHLORO-2-VINYLPHENYLSULFONATES BAYER CROPSCIENCE AG (DE) 2019-03-27 EP disclosed
US-20180079717-A1 PROCESS FOR PREPARING 3-CHLORO-2-VINYLPHENYLSULFONATES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-03-22 US disclosed
US-20180079717-A1 PROCESS FOR PREPARING 3-CHLORO-2-VINYLPHENYLSULFONATES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-03-22 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 (2 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-20180079717-A1 PROCESS FOR PREPARING 3-CHLORO-2-VINYLPHENYLSULFONATES AGPS, VARS1, VPS4B MRGPRX4 4108/4885ALDH1A1 3434/4885MAPT 4617/4885
US-10618872-B2 Process for preparing 3-chloro-2-vinylphenylsulfonates AGPS, VARS1, VPS4B MRGPRX4 4108/4885ALDH1A1 3434/4885MAPT 4617/4885

“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.