SCHEMBL19978062

SCHEMBL19978062

c1ccc2c(c1)sc1c2c2cccc3ccc4ccc1n4c32

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
GPR3 P46089 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
THRB P10828 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PRNP P04156 1/20 0.31
MAPK9 P45984 1/20 0.30
MAPK14 Q16539 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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
SCHEMBL19978065 0.89 TNKS (0.33) TNKSTNKS2MAPTMEN1RAB9A
SCHEMBL15416938 0.82 TNKS (0.36) TNKSTNKS2MAPTMEN1RAB9A
SCHEMBL15416774 0.82 TNKS (0.36) TNKSTNKS2MAPTMEN1RAB9A
SCHEMBL19978067 0.78 TNKS (0.39) TNKSTNKS2MAPTMEN1RAB9A
SCHEMBL19978059 0.73 ALDH1A1 (0.40) MAPTMEN1KMT2AGPR3ALDH1A1
SCHEMBL19978063 0.70 GPR3 (0.40) TNKSTNKS2MAPTMEN1RAB9A
SCHEMBL15126766 0.69 TDP1 (0.36) TNKSTNKS2MAPTMEN1RAB9A
SCHEMBL19978068 0.69 TDP1 (0.38) MEN1RAB9AKMT2AALDH1A1CYP1A2
SCHEMBL21718193 0.68 GPR3 (0.42) TNKSTNKS2MAPTMEN1RAB9A
SCHEMBL14951373 0.68 TDP1 (0.35) TNKSTNKS2MAPTMEN1RAB9A

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-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-03-22 US disclosed
US-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-03-22 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-20180083203-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES NES, CACNA2D4, PGLS TNKS 2444/4885TNKS2 2588/4885MAPT 451/4885

“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.