SCHEMBL13376964

SCHEMBL13376964

CC1CC(C)CC(c2cc(-c3ccccc3)c3ccc4c(-c5ccccc5)cc(C5CC(C)CC(C)C5)nc4c3n2)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.38
▸ KDM4E B2RXH2 7/20 0.38
▸ MAPT P10636 6/20 0.38
▸ HPGD P15428 5/20 0.38
▸ MEN1 O00255 5/20 0.38
▸ KMT2A Q03164 5/20 0.38
▸ NPSR1 Q6W5P4 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ TDP1 Q9NUW8 3/20 0.36
▸ GAA P10253 1/20 0.35
▸ ACACA Q13085 2/20 0.35
▸ LMNA P02545 3/20 0.34
▸ RECQL P46063 1/20 0.34
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ RAB9A P51151 1/20 0.33

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
SCHEMBL14560685 0.86 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL14560680 0.85 ALDH1A1 (0.47) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL14560691 0.84 ALDH1A1 (0.36) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL14560688 0.82 ALDH1A1 (0.41) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL10295457 0.80 ALDH1A1 (0.47) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL5401185 0.79 ADORA1 (0.47) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL14560690 0.78 ALDH1A1 (0.36) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL14560692 0.78 ALDH1A1 (0.34) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL14560693 0.78 KDM4E (0.34) ALDH1A1KDM4EMAPTHPGDMEN1
SCHEMBL14560674 0.78 KDM4E (0.39) ALDH1A1KDM4EMAPTHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1097981-B1 Organic electroluminescent device SONY CORP (JP) 2010-04-14 — — EP disclosed
US-7186469-B2 Bathophenanthroline compound and EL device SONY CORPORATION (JP) 2007-03-06 — — US disclosed
US-7186469-B2 Bathophenanthroline compound and EL device SONY CORPORATION (JP) 2007-03-06 — — US disclosed
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