SCHEMBL2732044

SCHEMBL2732044

O=C(Cl)c1ccc(CSc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.58
KMT2A Q03164 7/20 0.58
KDM4E B2RXH2 3/20 0.58
LMNA P02545 6/20 0.57
HPGD P15428 5/20 0.57
RAB9A P51151 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
NPC1 O15118 2/20 0.57
ALDH1A1 P00352 2/20 0.57
MAPT P10636 5/20 0.51
HTT P42858 3/20 0.51
HAO1 Q9UJM8 1/20 0.50
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
MAPK1 P28482 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
POLB P06746 2/20 0.48
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 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
SCHEMBL509527 0.85 HPGD (0.61) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL8144109 0.82 PLA2G10 (0.59) MEN1KMT2AKDM4ELMNAHPGD
Hydrochloric Acid SCHEMBL8144384 0.81 PLA2G10 (0.58) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL10055053 0.80 ALDH1A1 (0.57) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL28496339 0.79 MAPT (0.56) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL20545178 0.79 HDAC1 (0.72) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL3916950 0.78 RAB9A (0.61) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL3888099 0.78 HPGD (0.61) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL4266853 0.78 AKR1B1 (0.59) MEN1KMT2AKDM4ELMNAHPGD
SCHEMBL5315574 0.76 HAO1 (0.59) MEN1KMT2AKDM4ELMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102448978-A Novel Glucocorticoid Receptor Agonists PFIZER LTD 2012-05-09 CN disclosed
EP-2435462-A1 NOVEL GLUCOCORTICOID RECEPTOR AGONISTS Pfizer Limited (GB) 2012-04-04 EP disclosed
WO-2010136940-A1 NOVEL GLUCOCORTICOID RECEPTOR AGONISTS PFIZER LIMITED (GB) 2010-12-02 WO disclosed
WO-2010136940-A1 NOVEL GLUCOCORTICOID RECEPTOR AGONISTS PFIZER LIMITED (GB) 2010-12-02 WO disclosed
US-20100303758-A1 Novel Glucocorticoid Receptor Agonists GLOSSOP PAUL ALAN 2010-12-02 US disclosed
US-20100303758-A1 Novel Glucocorticoid Receptor Agonists GLOSSOP PAUL ALAN 2010-12-02 US disclosed
US-20100303758-A1 Novel Glucocorticoid Receptor Agonists GLOSSOP PAUL ALAN 2010-12-02 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 (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-20100303758-A1 Novel Glucocorticoid Receptor Agonists NR3C1, NR3C2, MC2R MEN1 3637/4885KMT2A 4072/4885KDM4E 3887/4885

“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.