SCHEMBL19985956

SCHEMBL19985956

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7sc6c54)n3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
EGLN1 Q9GZT9 1/20 0.30
LIMK1 P53667 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
SCHEMBL19986036 0.98 EGLN1 (0.31) EGLN1
SCHEMBL18086397 0.94 TNKS (0.32) MEN1KMT2AATMEGLN1LIMK1
SCHEMBL21707294 0.94 TNKS (0.32) MEN1KMT2AATMEGLN1LIMK1
SCHEMBL19985968 0.93 LIMK1 (0.30) LIMK1
SCHEMBL16206308 0.92 TNKS (0.33) MEN1KMT2AATMEGLN1
SCHEMBL17405415 0.92 EGLN1 (0.32) MEN1KMT2AATMEGLN1
SCHEMBL17405711 0.92 EGLN1 (0.32) MEN1KMT2AATMEGLN1
SCHEMBL22199909 0.89 LIMK1 (0.32) LIMK1
SCHEMBL19986186 0.89 MAPT (0.32) MEN1KMT2ALIMK1
SCHEMBL18086405 0.89 TNKS (0.30) ATM

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