SCHEMBL18083602

SCHEMBL18083602

Cc1ccc2c(c1)Oc1cc(C)ccc1N2c1cc(-c2cc(-c3cccc4ccccc34)cc(-c3cccc4ccccc34)c2)cc(-c2cc(-c3cccc4ccccc34)cc(-c3cccc4ccccc34)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ CHRNA1 P02708 1/20 0.36
▸ CHRNG P07510 1/20 0.36
▸ CHRNB1 P11230 1/20 0.36
▸ CHRNB2 P17787 1/20 0.36
▸ SLC6A2 P23975 1/20 0.36
▸ CHRNB4 P30926 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ CHRNA3 P32297 1/20 0.36
▸ CHRNA4 P43681 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ CHRND Q07001 1/20 0.36
▸ ENPP3 O14638 1/20 0.36
▸ ENPP1 P22413 1/20 0.36
▸ VDR P11473 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ CNR1 P21554 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ P2RX4 Q99571 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
SCHEMBL12620336 0.85 POLB (0.40) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL18083567 0.84 HTR1A (0.35) CYP1A2HRH4KDM4EALDH1A1
SCHEMBL12620244 0.84 POLB (0.41) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL18083574 0.84 GPR84 (0.36) VDRP2RX4CYP1A2CYP2A6TDP1
SCHEMBL16502134 0.84 ALDH1A1 (0.40) MAOAMAOBCHRNA1CHRNGCHRNB1
SCHEMBL18083601 0.81 MAOB (0.37) MAOAMAOBPOLBKDM4EALDH1A1
SCHEMBL18083575 0.81 CYP2A6 (0.42) POLBCYP1A2CYP2A6TDP1KDM4E
SCHEMBL14550965 0.79 POLB (0.38) CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL16502126 0.79 ALDH1A1 (0.38) MAOAMAOBCHRNA1CHRNGCHRNB1
SCHEMBL12433652 0.78 ELANE (0.44) MAOAMAOBVDRPOLBCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2301983-B1 PHENOXAZINE POLYMERIC COMPOUND AND LIGHT-EMITTING ELEMENT COMPRISING SAME SUMITOMO CHEMICAL CO (JP) 2016-09-21 — — EP disclosed
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