SCHEMBL17988958

SCHEMBL17988958

CC1(C)c2cc3c4ccccc4n(-c4ccccn4)c3cc2-c2ccc3ccccc3c21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 2/20 0.34
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ TUBB4A P04350 1/20 0.31
▸ TUBB P07437 1/20 0.31
▸ TUBA3C P0DPH7 1/20 0.31
▸ TUBA1B P68363 1/20 0.31
▸ TUBA4A P68366 1/20 0.31
▸ TUBB4B P68371 1/20 0.31
▸ TUBB3 Q13509 1/20 0.31
▸ TUBB2A Q13885 1/20 0.31
▸ TUBB8 Q3ZCM7 1/20 0.31

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
SCHEMBL17989026 0.89 MEN1 (0.33) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL17988948 0.85 MEN1 (0.35) MAT2AMEN1KMT2AALDH1A1LMNA
SCHEMBL17988942 0.84 MAT2A (0.33) MAT2AMEN1KMT2AALDH1A1KDM4E
SCHEMBL16999735 0.83 CYP17A1 (0.30) MAT2ACYP17A1CYP1A2
SCHEMBL17228848 0.83 MAT2A (0.34) MAT2AMEN1KMT2AALDH1A1LMNA
SCHEMBL17988886 0.83 KDM4E (0.44) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL17988933 0.83 MEN1 (0.36) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL17989038 0.83 PIK3CA (0.32) MEN1KMT2AKDM4EMAPTMAPK1
SCHEMBL802173 0.82 MAT2A (0.37) MAT2AMEN1KMT2AALDH1A1KDM4E
SCHEMBL17988965 0.81 ALDH1A1 (0.36) MAT2AMEN1KMT2AALDH1A1KDM4E

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-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 — — US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 — — US disclosed
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