SCHEMBL17636628

SCHEMBL17636628

c1ccc(-c2nnn(-c3ccccc3)c2-c2cccc3c4ccccc4n(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c23)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 5/20 0.43
TDO2 P48775 5/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
DHODH Q02127 8/20 0.42
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 1/20 0.36
DUSP3 P51452 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL17636681 0.92 IDO1 (0.42) IDO1TDO2NPC1RAB9ASMN1; SMN2
SCHEMBL21532500 0.92 IDO1 (0.37) IDO1TDO2NPC1RAB9ASMN1; SMN2
SCHEMBL17636627 0.90 IDO1 (0.43) IDO1TDO2NPC1RAB9ASMN1; SMN2
SCHEMBL21532771 0.89 IDO1 (0.37) IDO1TDO2NPC1RAB9ASMN1; SMN2
SCHEMBL21532506 0.88 IDO1 (0.36) IDO1TDO2NPC1RAB9ASMN1; SMN2
SCHEMBL21532761 0.87 IDO1 (0.34) IDO1TDO2NPC1RAB9ASMN1; SMN2
SCHEMBL21532749 0.87 IDO1 (0.34) IDO1TDO2NPC1RAB9ASMN1; SMN2
SCHEMBL17636818 0.87 IDO1 (0.49) IDO1TDO2DHODHGAA
SCHEMBL17636658 0.87 IDO1 (0.47) IDO1TDO2DHODHL3MBTL1GAA
SCHEMBL21532496 0.87 IDO1 (0.35) IDO1TDO2NPC1RAB9ASMN1; SMN2

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 IDO1 3268/4885TDO2 3216/4885NPC1 2223/4885

“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.