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SCHEMBL18965640

SCHEMBL18965640

CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccc(-c9ccccc9)cc8)n7)cc6)c6ccccc56)c5ccccc45)cc3)cc21

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 13/20 0.43
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ NTSR1 P30989 1/20 0.36
▸ ACACA Q13085 1/20 0.35
▸ ATM Q13315 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
SCHEMBL18965435 1.00 PDK2 (0.43) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL27129037 0.96 PDK2 (0.42) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL18965451 0.95 MEN1 (0.43) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL22115598 0.94 MEN1 (0.41) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23099363 0.94 PDK2 (0.40) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL17932725 0.94 PDK2 (0.40) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL18904425 0.93 PDK2 (0.39) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL17932827 0.93 PDK2 (0.48) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL22369701 0.93 PDK2 (0.48) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL19009492 0.93 PDK2 (0.48) PDK2MEN1KMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017099430-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2017-06-15 — — WO disclosed