SCHEMBL24614818

SCHEMBL24614818

Ic1cc2cc(I)c3sc4ccccc4c3c2c2c1sc1ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.41
MAPT P10636 4/20 0.40
TNKS O95271 2/20 0.40
TNKS2 Q9H2K2 2/20 0.40
PTPN1 P18031 1/20 0.37
RAB9A P51151 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
ATM Q13315 1/20 0.36
ALDH1A1 P00352 6/20 0.35
HPGD P15428 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HCRTR1 O43613 2/20 0.35
KDM4E B2RXH2 2/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALOX15 P16050 1/20 0.34
LIMK1 P53667 1/20 0.34
CDK5 Q00535 1/20 0.34

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
SCHEMBL24614819 0.91 MAPT (0.41) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL22011437 0.89 GPR3 (0.39) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL22011432 0.85 TNKS (0.46) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL24614971 0.83 PTPN1 (0.36) MAPTTNKSTNKS2PTPN1L3MBTL1
SCHEMBL24614802 0.79 PTPN1 (0.34) PTPN1ALOX5
SCHEMBL24659225 0.79 GPR3 (0.46) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL22011430 0.76 GPR3 (0.41) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL24171866 0.76 ALDH1A1 (0.43) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL22012010 0.75 GPR3 (0.57) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL19109094 0.75 GPR3 (0.57) GPR3MAPTTNKSTNKS2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220223801-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-07-14 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-20220223801-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES TMEM109, PIEZO1, L1CAM GPR3 4195/4885MAPT 2260/4885TNKS 3531/4885

“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.