SCHEMBL16996483

SCHEMBL16996483

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(N(c3ccc(-c4cccc5c4sc4ccccc45)cc3)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc21

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.48
PRKDC P78527 4/20 0.35
PARP14 Q460N5 1/20 0.35
PIK3CD O00329 1/20 0.31
BRD4 O60885 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 1/20 0.31
KCNH2 Q12809 1/20 0.31
BRDT Q58F21 1/20 0.31
GPR3 P46089 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
SCHEMBL16996360 1.00 ALOX5 (0.48) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL16996318 0.98 ALOX5 (0.46) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL26233244 0.98 ALOX5 (0.46) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL16996321 0.97 ALOX5 (0.45) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL16133392 0.97 ALOX5 (0.45) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL21141027 0.97 ALOX5 (0.45) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL19218469 0.96 ALOX5 (0.44) ALOX5PRKDCPARP14
SCHEMBL17816817 0.96 ALOX5 (0.44) ALOX5PRKDCPARP14
SCHEMBL16996325 0.94 ALOX5 (0.44) ALOX5PRKDCPARP14
SCHEMBL19218483 0.94 ALOX5 (0.44) ALOX5PRKDCPARP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11877509-B2 Organic light-emitting element LG CHEM, LTD. 2024-01-16 US disclosed
US-10897013-B2 Compound for organic electric device, organic electric device using same, and electronic device comprising same DUK SAN NEOLUX CO., LTD. (KR) 2021-01-19 US disclosed
US-20190058129-A1 NOVEL COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME DUK SAN NEOLUX CO., LTD. (KR) 2019-02-21 US disclosed
US-20150228899-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 US disclosed
US-20150228899-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 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 (3 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-20190058129-A1 NOVEL COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME OR10J3, VDAC2, OR51E2 ALOX5 1637/4885PRKDC 3179/4885PARP14 3771/4885
US-11877509-B2 Organic light-emitting element CRY1, CRY2, NR2E3 ALOX5 1351/4885PRKDC 4266/4885PARP14 3804/4885
US-10897013-B2 Compound for organic electric device, organic electric device using same, and electronic device comprising same OR10J3, VDAC2, ORAI2 ALOX5 1324/4885PRKDC 2831/4885PARP14 3756/4885

“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.