SCHEMBL180373

SCHEMBL180373

Cc1c(F)ccc(Cl)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.36
HTR2C P28335 6/20 0.36
HTR2B P41595 4/20 0.36
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
RAPGEF4 Q8WZA2 2/20 0.33
PNMT P11086 2/20 0.33
ADRA2A P08913 2/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
TP53 P04637 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TNF P01375 1/20 0.31
RIPK1 Q13546 1/20 0.31

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
SCHEMBL5317749 0.85 TP53 (0.38) HTR2ATP53MEN1KMT2ACLCN2
SCHEMBL4812657 0.83 HTR2A (0.39) HTR2AHTR2CHTR2BRAPGEF4LMNA
SCHEMBL29449511 0.81 ALDH1A1 (0.37) RAPGEF4ADRA2ATP53MEN1NPC1
SCHEMBL15497514 0.81 ALDH1A1 (0.37) RAPGEF4ADRA2ATP53MEN1NPC1
SCHEMBL13755137 0.79 ALDH1A1 (0.36) RAPGEF4ADRA2ATP53MEN1NPC1
SCHEMBL12225802 0.79 RAPGEF4 (0.33) HTR2AHTR2CHTR2BRAPGEF4ADRA2A
SCHEMBL29620412 0.79 ALDH1A1 (0.36) HTR2AHTR2CHTR2BRAPGEF4ADRA2A
SCHEMBL7550352 0.79 ALDH1A1 (0.36) HTR2AHTR2CHTR2BRAPGEF4ADRA2A
SCHEMBL8249627 0.79 ACHE (0.36) HTR2AHTR2CHTR2BCYP3A4RAPGEF4
SCHEMBL900037 0.77 ALDH1A1 (0.42) HTR2AHTR2CHTR2BCYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4273147-A1 SUBSTITUTED SPIROLACTAMS, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2023-11-08 EP disclosed
CN-110937994-B Method for synthesizing 2, 4-dichloro-6-fluorobenzoyl chloride by two-step chlorination process 浙江大洋生物科技集团股份有限公司 2022-04-22 CN disclosed
WO-2021043322-A1 AZEPINO PYRIMIDINE DERIVATIVES AND MEDICAL USE THEREOF 正大天晴药业集团南京顺欣制药有限公司 2021-03-11 WO disclosed
CN-110937994-A Method for synthesizing 2, 4-dichloro-6-fluorobenzoyl chloride by two-step chlorination process 浙江大洋生物科技集团股份有限公司 2020-03-31 CN disclosed
US-9914712-B2 Antibacterial thiazolecarboxylic acids ANTABIO SAS (FR) 2018-03-13 US disclosed
CN-103044181-A Method for preparing octene-1 by ethylene tetramerization reaction PETROCHINA CO LTD 2013-04-17 CN disclosed
US-20130023562-A1 NOVEL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2013-01-24 US disclosed
US-8314127-B2 Piperidine derivatives ASTRAZENECA AB (SE) 2012-11-20 US disclosed
EP-1912941-B1 PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2012-11-14 EP disclosed
EP-2402316-A1 Piperidine derivatives AstraZeneca AB (Publ) (SE) 2012-01-04 EP disclosed
US-20090253929-A1 Chemical Compounds ASTRAZENECA AB (SE) 2009-10-08 US disclosed
US-20080207688-A1 Novel Piperidine Derivatives ASTRAZENECA AB (SE) 2008-08-28 US disclosed
EP-1912941-A1 NOVEL PIPERIDINE DERIVATIVES AstraZeneca AB (SE) 2008-04-23 EP disclosed
EP-1824806-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2007-08-29 EP disclosed
WO-2007011293-A1 NOVEL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2007-01-25 WO disclosed
WO-2006062477-A1 CHEMICAL PROCESS ASTRAZENECA AB (SE) 2006-06-15 WO disclosed
WO-2006062476-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2006-06-15 WO disclosed
CN-1651142-A Catalyst component used for ethylene oligomerization, preparing process and application thereof DAQING PETROCHEMICAL BRANCH CO (CN) 2005-08-10 CN disclosed
CN-1108193-C Novel catalyst for ethylene trimerization, its preparation process and application RES INST BEIJING YANSHAN PETRO (CN) 2003-05-14 CN disclosed
CN-1256968-A Novel catalyst for ethylene trimerization, its preparation process and application RES INST BEIJING YANSHAN PETRO (CN) 2000-06-21 CN 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 (3 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-20080207688-A1 Novel Piperidine Derivatives CCR3, CCR1, CCR4 HTR2A 3423/4885HTR2C 2235/4885HTR2B 2351/4885
US-20130023562-A1 NOVEL PIPERIDINE DERIVATIVES CCR3, CCR1, CCR4 HTR2A 3423/4885HTR2C 2235/4885HTR2B 2351/4885
US-20090253929-A1 Chemical Compounds CYP4B1, CYP3A4, CYP1A1 HTR2A 3541/4885HTR2C 1953/4885HTR2B 2600/4885

“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.