SCHEMBL19986001

SCHEMBL19986001

c1ccc(-c2cccc(-c3cc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7sc6c54)nc4cnccc34)c2)cc1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.31
MAP3K8 P41279 1/20 0.31
DHODH Q02127 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
SCHEMBL19986015 0.95 EGFR (0.34) EGFRDHODH
SCHEMBL19986043 0.95 EGFR (0.35) EGFRDHODH
SCHEMBL19986050 0.92 EGFR (0.37) EGFR
SCHEMBL19986005 0.86 EGFR (0.40) EGFR
SCHEMBL19986028 0.86 EGFR (0.42) EGFR
SCHEMBL19986024 0.84 TOP1 (0.37)
SCHEMBL19986017 0.84 DHODH (0.30) DHODH
SCHEMBL19991968 0.83
SCHEMBL18805440 0.83 CYP11B1 (0.39) EGFRDHODH
SCHEMBL19986129 0.82 KDM4E (0.32) EGFRDHODH

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
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed