SCHEMBL20448673

SCHEMBL20448673

O=c1c(Sc2ccccc2Br)c(O)[nH]n1Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.38
CXCR2 P25025 1/20 0.37
LDHA P00338 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
PTPN11 Q06124 1/20 0.32
ALOX5 P09917 1/20 0.32
RGS4 P49798 1/20 0.32
F2 P00734 1/20 0.32
PLG P00747 1/20 0.32
ELANE P08246 1/20 0.32
CTSG P08311 1/20 0.32
CMA1 P23946 1/20 0.32
CTRC Q99895 1/20 0.32
PGR P06401 1/20 0.32
SRC P12931 1/20 0.32

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
SCHEMBL20448541 0.86 DAO (0.38) DAOCXCR2LDHAMEN1KMT2A
SCHEMBL20499664 0.76 PDE7A (0.36) MEN1KMT2A
SCHEMBL7837587 0.67 DAO (0.46) DAOCXCR2MEN1KMT2AKDM4E
SCHEMBL7839290 0.61 DAO (0.54) DAOCXCR2MEN1KMT2AALDH1A1
SCHEMBL9645952 0.60 ALOX5 (0.70) KDM4EALDH1A1ALOX5
SCHEMBL9645947 0.60 ALOX5 (0.50) KDM4EALDH1A1ALOX5
SCHEMBL3282096 0.60 LMNA (0.57) LDHAMEN1KMT2AALDH1A1LMNA
SCHEMBL29543575 0.60 LMNA (0.57) LDHAMEN1KMT2AALDH1A1LMNA
SCHEMBL13562510 0.59 PGR (0.53) DAOMEN1KMT2AKDM4EALDH1A1
SCHEMBL2621662 0.59 POLB (0.47) DAOMEN1KMT2ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180265467-A1 PYRAZOLIDINE DERIVATIVES AND RELATED COMPOUNDS SELVITA S.A. (PL) 2018-09-20 US claimed
EP-3356331-A1 PYRAZOLIDINE DERIVATIVES AND RELATED COMPOUNDS Selvita S.A. (PL) 2018-08-08 EP 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-20180265467-A1 PYRAZOLIDINE DERIVATIVES AND RELATED COMPOUNDS LDHB, LDHA, PDK1 DAO 1503/4885CXCR2 2532/4885LDHA 2/4885

“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.