SCHEMBL17645474

SCHEMBL17645474

Clc1cc(Cl)c(C(c2c(Cl)cc(Cl)cc2Cl)c2c(Cl)nc(Cl)nc2Cl)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
TSHR P16473 4/20 0.35
HSD17B10 Q99714 2/20 0.35
CYP3A4 P08684 1/20 0.35
RECQL P46063 1/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.32
HTT P42858 1/20 0.31
AHR P35869 2/20 0.31
HPGD P15428 1/20 0.31
SCN2A Q99250 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
SCHEMBL30583082 0.79 ALDH1A1 (0.36) ALDH1A1TSHRHSD17B10CYP3A4RECQL
SCHEMBL4077910 0.79 ALDH1A1 (0.56) ALDH1A1TSHRHSD17B10CYP3A4RECQL
SCHEMBL17645475 0.70 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10CYP3A4RECQL
SCHEMBL3672267 0.68 ALDH1A1 (0.35) ALDH1A1TSHRHSD17B10CYP3A4RECQL
SCHEMBL3665515 0.68 BCHE (0.41) ALDH1A1TSHRHSD17B10CYP3A4RECQL
SCHEMBL23517582 0.67 RAPGEF4 (0.45) ALDH1A1TSHRHSD17B10CYP3A4RECQL
SCHEMBL8626365 0.65 ALDH1A1 (0.42) ALDH1A1TSHRHSD17B10CYP3A4RECQL
SCHEMBL501488 0.64 ALDH1A1 (0.39) ALDH1A1TSHRALOX15
SCHEMBL3668782 0.62 ACHE (0.39) ALDH1A1TSHRALOX15HTTAHR
SCHEMBL30013667 0.62 ACHE (0.39) ALDH1A1TSHRALOX15HTTAHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9935271-B2 Organic electroluminescent device based on neutral free-radical electroluminescent material JILIN UNIVERSTIY (CN) 2018-04-03 US disclosed
US-9935271-B2 Organic electroluminescent device based on neutral free-radical electroluminescent material JILIN UNIVERSTIY (CN) 2018-04-03 US disclosed
US-9935271-B2 Organic electroluminescent device based on neutral free-radical electroluminescent material JILIN UNIVERSTIY (CN) 2018-04-03 US disclosed
US-20160099415-A1 ORGANIC ELECTROLUMINESCENT DEVICE BASED ON NEUTRAL FREE-RADICAL ELECTROLUMINESCENT MATERIAL JILIN UNIVERSITY (CN) 2016-04-07 US disclosed
US-20160099415-A1 ORGANIC ELECTROLUMINESCENT DEVICE BASED ON NEUTRAL FREE-RADICAL ELECTROLUMINESCENT MATERIAL JILIN UNIVERSITY (CN) 2016-04-07 US disclosed
US-20160099415-A1 ORGANIC ELECTROLUMINESCENT DEVICE BASED ON NEUTRAL FREE-RADICAL ELECTROLUMINESCENT MATERIAL JILIN UNIVERSITY (CN) 2016-04-07 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-20160099415-A1 ORGANIC ELECTROLUMINESCENT DEVICE BASED ON NEUTRAL FREE-RADICAL ELECTROLUMINESCENT MATERIAL MT-ND4L, FARS2, GPX4 ALDH1A1 2101/4885TSHR 993/4885HSD17B10 4136/4885

“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.