SCHEMBL18548730

SCHEMBL18548730

ClC(Cl)(Cl)c1ccn2c(c1)nc1ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
KDM4E B2RXH2 6/20 0.43
HPGD P15428 5/20 0.43
GLA P06280 4/20 0.43
GAA P10253 4/20 0.43
POLB P06746 2/20 0.43
HSD17B10 Q99714 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALK Q9UM73 2/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PTPN1 P18031 2/20 0.40
PTPN2 P17706 1/20 0.40
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL25457542 0.84 ADORA2A (0.44) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL832843 0.75 RAD51 (0.51) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL21623397 0.75 ALK (0.48) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL24553487 0.75 PTPN2 (0.51) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL22906838 0.73 KDR (0.50) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL21622870 0.72 LCK (0.52) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL839837 0.71 ALDH1A1 (0.62) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL29660223 0.69 PTPN1 (0.41) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL2162804 0.69 PTPN1 (0.41) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL22906841 0.69 FLT3 (0.52) ALDH1A1KDM4EHPGDGAAPOLB

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-10137211-B2 Probes for imaging Huntingtin protein CHDI FOUNDATION, INC. (US) 2018-11-27 US disclosed
US-20170056535-A1 PROBES FOR IMAGING HUNTINGTIN PROTEIN CHDI FOUNDATION, INC. 2017-03-02 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 (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-20170056535-A1 PROBES FOR IMAGING HUNTINGTIN PROTEIN HTT, HYPK, HSPBP1 ALDH1A1 3976/4885KDM4E 4585/4885HPGD 2107/4885
US-10137211-B2 Probes for imaging Huntingtin protein HTT, HYPK, FABP7 ALDH1A1 4205/4885KDM4E 4598/4885HPGD 2408/4885

“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.