SCHEMBL18926317

SCHEMBL18926317

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c5ccc6c7ccccc7sc6c5ccc43)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
MAPT P10636 1/20 0.32
GPR3 P46089 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
ALOX5 P09917 1/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL14979382 0.94 TNKS (0.33) TNKSTNKS2MAPTGPR3L3MBTL1
SCHEMBL16521269 0.92 TNKS (0.32) TNKSTNKS2MAPTGPR3ALOX5
SCHEMBL21365564 0.92 TNKS (0.32) TNKSTNKS2MAPTGPR3ALOX5
SCHEMBL15625613 0.92 TNKS (0.32) TNKSTNKS2MAPTGPR3ALOX5
SCHEMBL16437629 0.92 TNKS (0.32) TNKSTNKS2MAPTGPR3
SCHEMBL16297509 0.92 TNKS (0.32) TNKSTNKS2MAPTGPR3LMNA
SCHEMBL18566533 0.91 TNKS (0.33) TNKSTNKS2MAPTGPR3L3MBTL1
SCHEMBL17990862 0.91 TNKS (0.32) TNKSTNKS2MAPT
SCHEMBL17990923 0.91 ATM (0.36) TNKSTNKS2MAPTL3MBTL1ALOX5
SCHEMBL16437632 0.90 TNKS (0.35) TNKSTNKS2MAPTGPR3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9806271-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-10-31 US disclosed
US-9806271-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-10-31 US disclosed
US-20170162797-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-06-08 US disclosed
US-20170162797-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-06-08 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-20170162797-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME L1CAM, CHRM1, OR10J3 TNKS 3820/4885TNKS2 4086/4885MAPT 3098/4885

“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.