SCHEMBL17125537

SCHEMBL17125537

CCn1c2ccccc2c2cc(-c3ccc(-c4nnc(-c5ccc(-c6ccc7c(c6)c6ccccc6n7Cc6ccccc6)cc5)o4)cc3)ccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.52
▸ POLB P06746 4/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ LMNA P02545 3/20 0.52
▸ CYP19A1 P11511 1/20 0.49
▸ NPY5R Q15761 4/20 0.47
▸ MEN1 O00255 5/20 0.45
▸ KMT2A Q03164 5/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ HBB P68871 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ TP53 P04637 3/20 0.45
▸ TSPO P30536 1/20 0.44
▸ PTGES O14684 1/20 0.44
▸ PTGER4 P35408 1/20 0.43

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
SCHEMBL17125540 0.94 CYP19A1 (0.55) MAPTPOLBALDH1A1LMNACYP19A1
SCHEMBL12680686 0.92 MAPT (0.56) MAPTPOLBALDH1A1LMNANPY5R
SCHEMBL17125538 0.92 NPY5R (0.53) MAPTPOLBALDH1A1LMNANPY5R
SCHEMBL17125535 0.91 CYP19A1 (0.49) MAPTPOLBALDH1A1LMNACYP19A1
SCHEMBL17125522 0.87 ALDH1A1 (0.49) MAPTPOLBALDH1A1LMNANPY5R
SCHEMBL17125568 0.84 CYP19A1 (0.58) MAPTPOLBALDH1A1LMNACYP19A1
SCHEMBL24714161 0.84 CYP19A1 (0.57) MAPTPOLBALDH1A1LMNACYP19A1
SCHEMBL13564162 0.82 CYP19A1 (0.59) MAPTPOLBALDH1A1LMNACYP19A1
SCHEMBL17125551 0.81 MAPT (0.42) MAPTPOLBALDH1A1LMNANPY5R
SCHEMBL17125663 0.81 CYP19A1 (0.54) MAPTPOLBALDH1A1LMNACYP19A1

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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