SCHEMBL23874685

SCHEMBL23874685

CC(C)(CCC(C)(C)c1nc(-c2ccccc2)c2oc3ccccc3c2n1)c1nc(-c2ccc(-c3cccc(CC(C)(C)c4nc(-c5cccc(-c6ccccc6)c5)c5c(n4)sc4ccccc45)c3)cc2)c2c(n1)sc1ccccc12

nearest known ligand 0.31

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.31
▸ PKM P14618 1/20 0.31
▸ ELANE P08246 1/20 0.31
▸ ATM Q13315 1/20 0.30
▸ TSHR P16473 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ ALOX12 P18054 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ GGPS1 O95749 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL23874684 0.83 ELANE (0.33) ELANE
SCHEMBL24474776 0.79 MAPT (0.36) MAPTATMTSHRKMT2AMEN1
SCHEMBL24701231 0.78 MAPT (0.37) MAPTATMTSHRKMT2AMEN1
SCHEMBL24700746 0.76 TNKS (0.33) MAPTTSHRKMT2AALDH1A1LMNA
SCHEMBL24474640 0.76 ELANE (0.33) ELANE
SCHEMBL23473798 0.74 ELANE (0.35) MAPTELANEKMT2AMEN1ALDH1A1
SCHEMBL23473689 0.73 TSHR (0.43) MAPTTSHRKMT2AMEN1ALDH1A1
SCHEMBL23874810 0.72 MAPT (0.45) MAPTTSHRKMT2AMEN1ALDH1A1
SCHEMBL23920735 0.72 PIM1 (0.39) MAPTTSHRKMT2AMEN1ALDH1A1
SCHEMBL19161963 0.71 ELANE (0.37) MAPTELANEALDH1A1NPSR1

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
US-20210305519-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-09-30 — — US disclosed
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