SCHEMBL1463590

SCHEMBL1463590

Cn1c(-c2ccc(F)cc2)nc2cc(Cl)ccc2c1=O

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 9/20 0.60
EGFR P00533 4/20 0.51
KMT2A Q03164 3/20 0.51
KDM4E B2RXH2 2/20 0.50
HTT P42858 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
POLB P06746 1/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
NLRP3 Q96P20 1/20 0.46

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
SCHEMBL1463877 0.92 EGFR (0.55) CYP3A4EGFRKMT2AKDM4EHTT
SCHEMBL1464587 0.86 EGFR (0.67) CYP3A4EGFRKMT2AKDM4EHTT
SCHEMBL1463978 0.82 KCNH2 (0.60) CYP3A4KMT2AKDM4EMEN1POLB
SCHEMBL8922268 0.80 CYP3A4 (0.49) CYP3A4EGFRKMT2AKDM4EHTT
SCHEMBL14161046 0.80 ADRA1A (0.55) KMT2AKDM4ESMN1; SMN2MEN1POLB
SCHEMBL7770758 0.79 CYP3A4 (0.48) CYP3A4EGFRKMT2AKDM4EHTT
SCHEMBL1463838 0.79 KCNH2 (0.60) CYP3A4EGFRKDM4ERXFP1POLB
SCHEMBL8845824 0.78 KMT2A (0.57) CYP3A4EGFRKMT2AMEN1RXFP1
SCHEMBL27926165 0.77 ALDH1A1 (0.60) KMT2AKDM4ESMN1; SMN2MEN1RXFP1
SCHEMBL31276870 0.76 KDM4E (0.70) EGFRKMT2AKDM4EHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110071148-A1 COMPOUNDS AS THE ESTROGEN RELATED RECEPTORS MODULATORS AND THE USES THEREOF GUANGZHOU INSTITUTE OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2011-03-24 US claimed
US-20110071148-A1 COMPOUNDS AS THE ESTROGEN RELATED RECEPTORS MODULATORS AND THE USES THEREOF GUANGZHOU INSTITUTE OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2011-03-24 US disclosed
EP-2266962-A1 THE COMPOUNDS AS THE ESTROGEN RELATED RECEPTORS MODULATORS AND THE USES THEREOF Guangzhou Institute Of Biomedicine And Health, Chinese Academy Of Sciences (CN) 2010-12-29 EP disclosed
CN-101531638-A Compounds useful as estrogen-related receptor modulators and uses thereof CHINESE ACADEMY OF SCIENCES GU 2009-09-16 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 (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-20110071148-A1 COMPOUNDS AS THE ESTROGEN RELATED RECEPTORS MODULATORS AND THE USES THEREOF ESRRA, ESRRB, ESRRG CYP3A4 142/4885EGFR 144/4885KMT2A 1845/4885

“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.