SCHEMBL21370204

SCHEMBL21370204

c1ccc(-c2nc(-c3cc(-c4cc5ccccc5c5ccccc45)cc(-n4c5ccccc5c5ccccc54)c3)cc(-c3cccc4c3oc3ccccc34)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.35
TSHR P16473 3/20 0.32
PRKDC P78527 3/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
GGPS1 O95749 1/20 0.32
CYP11B1 P15538 1/20 0.31
MAPT P10636 5/20 0.31
KDM4E B2RXH2 4/20 0.31
LMNA P02545 2/20 0.31
MAPK1 P28482 2/20 0.31
HSD17B10 Q99714 2/20 0.31
ALDH1A1 P00352 5/20 0.31
HPGD P15428 2/20 0.31
POLB P06746 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
GAA P10253 1/20 0.30
TP53 P04637 1/20 0.30
NFKB1 P19838 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
SCHEMBL21370168 0.96 ALOX5 (0.35) ALOX5TSHRPRKDCPIK3CDPIK3CB
SCHEMBL21369943 0.95 ALOX5 (0.34) ALOX5PRKDC
SCHEMBL21369690 0.93 ALOX5 (0.35) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL21369892 0.91 ALOX5 (0.34) ALOX5PRKDC
SCHEMBL22136520 0.91 ALOX5 (0.39) ALOX5TSHRPRKDCPIK3CDPIK3CB
SCHEMBL21370331 0.90 ALOX5 (0.36) ALOX5TSHRPRKDCPIK3CDPIK3CB
SCHEMBL23760531 0.90 ALOX5 (0.41) ALOX5TSHRPRKDCPIK3CDPIK3CB
SCHEMBL16185419 0.90 ALOX5 (0.41) ALOX5TSHRPRKDCPIK3CDPIK3CB
SCHEMBL22136566 0.90 CYP11B1 (0.32) TSHRCYP11B1MAPTKDM4ELMNA
SCHEMBL21370330 0.89 ALOX5 (0.37) ALOX5TSHRPRKDCPIK3CDPIK3CB

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
WO-2020130724-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 두산솔루스 주식회사 2020-06-25 WO disclosed
US-20190288215-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME SOULBRAIN CO., LTD. (KR) 2019-09-19 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-20190288215-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CYP1A1, CYP1B1 ALOX5 449/4885TSHR 4314/4885PRKDC 4490/4885

“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.