SCHEMBL17125671

SCHEMBL17125671

Cn1c2ccccc2c2cc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5C)c4nsnc34)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.45
▸ MAPT P10636 3/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ PABPC1 P11940 1/20 0.38
▸ KIF11 P52732 1/20 0.38
▸ NPY5R Q15761 2/20 0.37
▸ RXRA P19793 1/20 0.37
▸ RXRB P28702 1/20 0.37
▸ PTGER4 P35408 2/20 0.36
▸ PSEN1 P49768 1/20 0.36
▸ PSEN2 P49810 1/20 0.36
▸ APH1B Q8WW43 1/20 0.36
▸ NCSTN Q92542 1/20 0.36

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
SCHEMBL17125672 0.91 NPY5R (0.48) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL17125669 0.88 CYP19A1 (0.48) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL20022387 0.86 GPR3 (0.39) GPR3KDM4EMAPTALDH1A1HSD17B10
SCHEMBL17125670 0.85 NPY5R (0.52) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL29649143 0.83 L3MBTL1 (0.50) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL16188004 0.83 L3MBTL1 (0.50) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL20840733 0.82 TP53 (0.41) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL17125596 0.81 L3MBTL1 (0.47) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL17125668 0.80 CYP19A1 (0.54) KDM4EMAPTALDH1A1HSD17B10KMT2A
SCHEMBL17809442 0.79 GPR3 (0.59) GPR3KDM4EMAPTALDH1A1HSD17B10

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
US-10240084-B2 Non-crystallizable pi-conjugated molecular glass mixtures, charge transporting molecular glass mixtures, luminescent molecular glass mixtures, or combinations thereof for organic light emitting diodes and other organic electronics and photonics applications MOLECULAR GLASSES, INC. (US) 2019-03-26 — — US disclosed
US-20150275076-A1 Non-crystallizable Pi-conjugated Molecular Glass Mixtures, Charge Transporting Molecular Glass Mixtures, Luminescent Molecular Glass Mixtures, or Combinations Thereof for Organic Light Emitting Diodes and other Organic Electronics and Photonics Applications Molaire Consulting 2015-10-01 — — US disclosed
US-20150275076-A1 Non-crystallizable Pi-conjugated Molecular Glass Mixtures, Charge Transporting Molecular Glass Mixtures, Luminescent Molecular Glass Mixtures, or Combinations Thereof for Organic Light Emitting Diodes and other Organic Electronics and Photonics Applications Molaire Consulting 2015-10-01 — — US disclosed
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