SCHEMBL17636680

SCHEMBL17636680

c1cncc(-c2nc(-c3ccc4c(c3)c3ccccc3n4-c3cccc(-n4c5ccccc5c5ccccc54)c3)n(-c3cccnc3)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNA5 P30532 1/20 0.37
CHRNA4 P43681 1/20 0.37
PTGER4 P35408 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
GRM1 Q13255 1/20 0.36
CYP1A2 P05177 1/20 0.36
METAP2 P50579 1/20 0.36
CYP11B2 P19099 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
SCHEMBL17636669 0.96 MAPT (0.42) MAPTGRM1CYP1A2METAP2
SCHEMBL17636713 0.94 MAPT (0.40) MAPTPOLBSMN1; SMN2RXFP1CHRNB2
SCHEMBL17636678 0.91 MAPT (0.43) MAPTPOLBSMN1; SMN2RXFP1
SCHEMBL17636653 0.90 MAPT (0.42) MAPTPOLBSMN1; SMN2RXFP1NPC1
SCHEMBL17636656 0.90 MAPT (0.42) MAPT
SCHEMBL17636641 0.87 MAPT (0.41) MAPTPOLBSMN1; SMN2RXFP1CHRNB2
SCHEMBL17636650 0.86 MAPT (0.43) MAPTPOLBSMN1; SMN2RXFP1
SCHEMBL17636693 0.86 MAPT (0.39) MAPTPOLBSMN1; SMN2RXFP1CHRNB2
SCHEMBL17636664 0.86 PTGER4 (0.41) SMN1; SMN2PTGER4NPC1RAB9A
SCHEMBL17636631 0.84 MAPT (0.44) MAPTSMN1; SMN2RAB9ACYP11B2

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-9960365-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-05-01 US disclosed
US-9960365-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-05-01 US disclosed
US-20160093811-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-03-31 US disclosed
US-20160093811-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-03-31 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-20160093811-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNT1, CCNA1 MAPT 1845/4885POLB 1540/4885SMN1; SMN2 3082/4885

“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.