SCHEMBL17601980

SCHEMBL17601980

C=Cc1cccc2c1N(C)Cc1cc(OC(=O)c3ccc(Br)cc3)c(OC(=O)c3ccc(Br)cc3)cc1-2

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
PABPC1 P11940 1/20 0.35
MAPT P10636 4/20 0.35
KMT2A Q03164 4/20 0.35
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TSHR P16473 1/20 0.34
PTPN1 P18031 1/20 0.34
ACHE P22303 1/20 0.33
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KLF5 Q13887 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
SCHEMBL15993866 0.91 KMT2A (0.38) MAPTKMT2AMEN1SMN1; SMN2ACHE
SCHEMBL15993883 0.84 ACHE (0.37) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL17601998 0.84 MAPT (0.40) ESR1ESR2MAPTKMT2AGAA
SCHEMBL15993869 0.81 DRD1 (0.36) ACHE
SCHEMBL15993783 0.81 ACHE (0.37) KMT2AMEN1ACHE
SCHEMBL17602033 0.80 ALOX15 (0.36) ACHE
SCHEMBL22271831 0.78 ACHE (0.52) MAPTKMT2AMEN1ACHELMNA
SCHEMBL22760876 0.77 ACHE (0.40) ACHE
SCHEMBL22761232 0.75 ACHE (0.38) MAPTALDH1A1ACHEHTT
SCHEMBL17601999 0.74 ADRA2A (0.41) TSHRACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9682954-B2 Phenanthridine derivatives, preparation methods and uses thereof KUNMING INSTITUTE OF BOTANY, THE CHINESE ACADEMY OF SCIENCES (CN) 2017-06-20 US claimed
US-20160083364-A1 Phenanthridine Derivatives, Preparation Methods and Uses Thereof CENTER FOR EXCELLENCE IN MOLECULAR CELL SCIENCE, CHINESE ACADEMY OF SCIENCES (CN) 2016-03-24 US claimed
US-9682954-B2 Phenanthridine derivatives, preparation methods and uses thereof KUNMING INSTITUTE OF BOTANY, THE CHINESE ACADEMY OF SCIENCES (CN) 2017-06-20 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-20160083364-A1 Phenanthridine Derivatives, Preparation Methods and Uses Thereof CTNNB1, WNT3A, WNT1 ESR1 2543/4885ESR2 566/4885PABPC1 1849/4885

“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.