SCHEMBL13089976

SCHEMBL13089976

Cc1cc(C)cc(N(c2ccc(C(C)C)cc2)c2ccc3c4ccc(N(c5ccc(C(C)C)cc5)c5cc(C)cc(C)c5)cc4n(-c4ccccc4)c3c2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 7/20 0.38
▸ KDM4E B2RXH2 3/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ ATM Q13315 1/20 0.35
▸ TDP1 Q9NUW8 3/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ DHFR P00374 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ PRMT5 O14744 2/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ KIF11 P52732 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ MAPT P10636 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ CNR1 P21554 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
SCHEMBL21076167 0.88 MAT2A (0.39) MAT2AKDM4EL3MBTL1ATMTDP1
SCHEMBL13089977 0.86 MAT2A (0.39) MAT2AKDM4EL3MBTL1ATMTDP1
SCHEMBL13089981 0.84 NOTUM (0.36) MAT2AKDM4EL3MBTL1ATMHTT
SCHEMBL23029123 0.82 TDP1 (0.33) MAT2AKDM4EL3MBTL1TDP1NPSR1
SCHEMBL10132179 0.81 KDM4E (0.43) MAT2AKDM4EL3MBTL1ATMTDP1
SCHEMBL14073198 0.80 KDM4E (0.42) MAT2AKDM4EL3MBTL1ATMLMNA
SCHEMBL25749617 0.80 KDM4E (0.47) MAT2AKDM4EL3MBTL1ATMHTT
SCHEMBL22725744 0.79 L3MBTL1 (0.47) MAT2AKDM4EL3MBTL1ATMTDP1
SCHEMBL10132175 0.79 L3MBTL1 (0.50) MAT2AKDM4EL3MBTL1ATMTDP1
SCHEMBL9913012 0.79 KDM4E (0.37) MAT2AKDM4EL3MBTL1ATMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100259163-A1 POLYMER COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2010-10-14 — — US disclosed
US-20100259163-A1 POLYMER COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2010-10-14 — — US disclosed
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