SCHEMBL17112767

SCHEMBL17112767

CCn1c2ccccc2c2ccccc21.c1ccc(Cn2c3ccccc3c3ccccc32)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.81
▸ P2RX4 Q99571 2/20 0.65
▸ ALDH1A1 P00352 3/20 0.58
▸ MAPT P10636 4/20 0.54
▸ MEN1 O00255 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ HPGD P15428 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ HBB P68871 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ TP53 P04637 3/20 0.52
▸ LMNA P02545 1/20 0.50
▸ NPY5R Q15761 1/20 0.50
▸ HDAC3 O15379 1/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.50
▸ PTGER4 P35408 1/20 0.50

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
SCHEMBL17104579 1.00 CYP19A1 (0.81) CYP19A1P2RX4ALDH1A1MAPTMEN1
SCHEMBL30007452 0.90 CYP19A1 (1.00) CYP19A1P2RX4ALDH1A1MAPTMEN1
SCHEMBL151053 0.90 CYP19A1 (1.00) CYP19A1P2RX4ALDH1A1MAPTMEN1
Ammonia Solution, Strong SCHEMBL29210102 0.88 CYP19A1 (0.95) CYP19A1P2RX4ALDH1A1MAPTMEN1
SCHEMBL9398256 0.88 CYP19A1 (0.95) CYP19A1P2RX4ALDH1A1MAPTMEN1
Bromide SCHEMBL28888744 0.88 CYP19A1 (0.95) CYP19A1P2RX4ALDH1A1MAPTMEN1
SCHEMBL29963695 0.85 ALDH1A1 (0.75) CYP19A1ALDH1A1MAPTMEN1KMT2A
SCHEMBL151563 0.85 ALDH1A1 (0.75) CYP19A1ALDH1A1MAPTMEN1KMT2A
SCHEMBL29360167 0.85 ALDH1A1 (0.75) CYP19A1ALDH1A1MAPTMEN1KMT2A
SCHEMBL17125568 0.85 CYP19A1 (0.58) CYP19A1P2RX4ALDH1A1MAPTMEN1

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 4 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
CN-106471094-A Pi-conjugated Semiconductor Organic glass mixture for OLED and OED 分子玻璃公司 2017-03-01 — — CN disclosed
EP-3122841-A2 PI-CONJUGATED SEMICONDUCTIVE ORGANIC GLASS MIXTURES FOR OLED AND OEDS Molecular Glasses, Inc. (US) 2017-02-01 — — EP disclosed
WO-2015148327-A2 PI-CONJUGATED SEMICONDUCTIVE ORGANIC GLASS MIXTURES FOR OLED AND OEDS MOLAIRE CONSULTING LLC (US) 2015-10-01 — — WO disclosed
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