SCHEMBL16307355

SCHEMBL16307355

CC1(C)c2ccccc2-c2cc3c4cc(N)ccc4n(-c4ccccc4)c3cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 5/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ HBB P68871 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ PGR P06401 3/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ PDK2 Q15119 2/20 0.34
▸ NPC1 O15118 2/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ SMN1; SMN2 Q16637 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
SCHEMBL10043604 0.95 ALDH1A1 (0.40) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL14822310 0.88 PGR (0.37) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL783418 0.88 PGR (0.37) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL783308 0.88 KDM4E (0.50) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL802707 0.87 PGR (0.36) KDM4EPGRL3MBTL1ATMPDK2
SCHEMBL15040987 0.87 PGR (0.36) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL18381855 0.87 KDM4E (0.49) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL14849829 0.86 PGR (0.37) KDM4EMEN1KMT2APGRL3MBTL1
SCHEMBL14822554 0.86 KDM4E (0.45) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL10001519 0.86 PGR (0.35) KDM4EPGRL3MBTL1ATMPDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170317298-A1 ORGANIC METAL COMPLEXES UDC IRELAND LIMITED (IE) 2017-11-02 — — US disclosed
US-20170317298-A1 ORGANIC METAL COMPLEXES UDC IRELAND LIMITED (IE) 2017-11-02 — — US disclosed
US-9748502-B2 Organic metal complexes MERCK PATENT GMBH (DE) 2017-08-29 — — US disclosed
US-9748502-B2 Organic metal complexes MERCK PATENT GMBH (DE) 2017-08-29 — — US disclosed
WO-2016013875-A1 ORGANIC ELECTROLUMINESCENT DEVICE ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2016-01-28 — — WO disclosed
US-20140371825-A1 ORGANIC METAL COMPLEXES UDC IRELAND LIMITED (IE) 2014-12-18 — — US disclosed
US-20140371825-A1 ORGANIC METAL COMPLEXES UDC IRELAND LIMITED (IE) 2014-12-18 — — US disclosed
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