SCHEMBL4568233

SCHEMBL4568233

Nc1cc(C2CC2)c(F)cc1Br

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 10/20 0.43
KDM1B Q8NB78 6/20 0.43
KCNH2 Q12809 4/20 0.43
MEN1 O00255 1/20 0.31
APAF1 O14727 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
NR4A1 P22736 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
PTPN11 Q06124 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL21999828 0.81 ALDH1A1 (0.34) KDM1AKDM1BKCNH2ALDH1A1
SCHEMBL30977427 0.77 ALDH1A1 (0.34) KDM1AKDM1BKCNH2ALDH1A1
SCHEMBL31424337 0.77 KDM1A (0.47) KDM1AKDM1BKCNH2
SCHEMBL23250453 0.77 KDM1A (0.47) KDM1AKDM1BKCNH2
SCHEMBL4568235 0.76 KDM1A (0.41) KDM1AKDM1BMEN1APAF1ALDH1A1
SCHEMBL15428005 0.75 MEN1 (0.33) MEN1APAF1ALDH1A1POLBMAPT
SCHEMBL18840501 0.74 POLB (0.32) MEN1POLBMAPTKMT2AL3MBTL1
SCHEMBL2536617 0.73 ALDH1A1 (0.41) KDM1AKDM1BKCNH2MEN1APAF1
SCHEMBL24207578 0.72 POLB (0.41) KDM1AMEN1ALDH1A1POLBMAPT
SCHEMBL21597029 0.71 KDM1A (0.43) KDM1AKDM1BKCNH2MEN1APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220106288-A1 NOVEL SULFONEUREA COMPOUNDS INFLAZOME LIMITED (IE) 2022-04-07 US disclosed
EP-3837243-A1 NOVEL SULFONEUREA COMPOUNDS Inflazome Limited (IE) 2021-06-23 EP disclosed
CN-112888675-A Novel sulfonylurea compound 英夫拉索姆有限公司 2021-06-01 CN disclosed
WO-2020035466-A1 NOVEL SULFONEUREA COMPOUNDS INFLAZOME LIMITED (IE) 2020-02-20 WO disclosed
WO-2020035466-A1 NOVEL SULFONEUREA COMPOUNDS INFLAZOME LIMITED (IE) 2020-02-20 WO disclosed
EP-2474530-B1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL (JP) 2014-09-03 EP disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, LTB4R KDM1A 1390/4885KDM1B 1386/4885KCNH2 895/4885
US-20220106288-A1 NOVEL SULFONEUREA COMPOUNDS NLRP3, NLRP1, PYCARD KDM1A 707/4885KDM1B 1900/4885KCNH2 1532/4885

“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.