SCHEMBL13829174

SCHEMBL13829174

Cc1ccc2c(c1)sc1cc(N(c3ccccc3)c3ccc(-c4ccccc4)c4ccccc34)ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.36
▸ RXRA P19793 1/20 0.34
▸ RXRB P28702 1/20 0.34
▸ APP P05067 2/20 0.32
▸ SNCA P37840 2/20 0.32
▸ TNF P01375 1/20 0.32
▸ NOD1 Q9Y239 1/20 0.32
▸ BCL2L1 Q07817 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ RAB9A P51151 2/20 0.31
▸ BCHE P06276 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL26687127 0.86 ALDH1A1 (0.37) ABCB1RXRARXRBAPPRAB9A
SCHEMBL26687118 0.86 ALDH1A1 (0.37) ABCB1RXRARXRBAPPRAB9A
SCHEMBL20109649 0.86 F9 (0.35) ABCB1RXRARXRBRAB9AALDH1A1
SCHEMBL14295405 0.86 ALDH1A1 (0.39) ABCB1RXRARXRBAPPRAB9A
SCHEMBL21966050 0.85 ALDH1A1 (0.36) ABCB1RXRARXRBRAB9APOLB
SCHEMBL13731438 0.85 ABCB1 (0.34) ABCB1RXRARXRBRAB9AALDH1A1
SCHEMBL20109633 0.85 F9 (0.36) ABCB1RXRARXRBRAB9AALDH1A1
SCHEMBL15614252 0.83 ALDH1A1 (0.35) ABCB1RXRARXRBRAB9APOLB
SCHEMBL22760527 0.83 ABCB1 (0.39) ABCB1APPSNCATNFNOD1
SCHEMBL20109595 0.82 ALDH1A1 (0.40) BCL2L1MCL1RAB9AMEN1NPC1

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
WO-2012148127-A2 COMPOUND, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산하이메탈(주) (KR) 2012-11-01 — — WO disclosed
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