SCHEMBL17014044

SCHEMBL17014044

c1ccc(-c2c3ccccc3c(-c3cccc(-c4cc(-c5cccnc5)nc(-c5ccc(-c6ccncc6)cc5)n4)c3)c3ccccc23)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 3/20 0.51
▸ DHODH Q02127 2/20 0.47
▸ CYP3A4 P08684 4/20 0.45
▸ CYP2C9 P11712 5/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ CYP1A2 P05177 3/20 0.42
▸ CYP2D6 P10635 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ GLA P06280 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ CLK4 Q9HAZ1 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ KMO O15229 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41

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
SCHEMBL17013975 0.95 CYP19A1 (0.51) CYP19A1DHODHCYP3A4CYP2C9ALDH1A1
SCHEMBL17013979 0.95 CYP19A1 (0.51) CYP19A1DHODHCYP3A4CYP2C9ALDH1A1
SCHEMBL17014043 0.95 CYP19A1 (0.51) CYP19A1DHODHCYP3A4CYP2C9ALDH1A1
SCHEMBL17014040 0.95 CYP19A1 (0.54) CYP19A1DHODHCYP3A4CYP2C9ALDH1A1
SCHEMBL17014034 0.92 DHODH (0.52) CYP19A1DHODHCYP3A4CYP2C9ALDH1A1
SCHEMBL17014063 0.92 DHODH (0.52) CYP19A1DHODHCYP3A4CYP2C9ALDH1A1
SCHEMBL22227773 0.91 CYP19A1 (0.55) CYP19A1DHODHCYP3A4CYP2C9ALDH1A1
SCHEMBL24252241 0.91 DHODH (0.53) CYP19A1DHODHCYP3A4CYP2C9ALDH1A1
SCHEMBL17014071 0.91 MAPT (0.49) DHODHCYP3A4CYP2C9ALDH1A1MEN1
SCHEMBL17014027 0.91 MAPT (0.49) DHODHCYP3A4CYP2C9ALDH1A1MEN1

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-10230051-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-12 — — US disclosed
US-20150236264-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-20 — — US disclosed
US-20150236264-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-20 — — US disclosed
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