SCHEMBL10064600

SCHEMBL10064600

C=Cc1ccc(Cn2c3ccc(-n4c5c(c6ccccc64)C=CCC5)cc3c3cc(-n4c5c(c6ccccc64)C=CCC5)ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PSMD14 O00487 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CA1 P00915 3/20 0.36
▸ CA2 P00918 3/20 0.36
▸ TP53 P04637 5/20 0.35
▸ CYP19A1 P11511 1/20 0.33
▸ HTR6 P50406 1/20 0.33
▸ HDAC1 Q13547 3/20 0.33
▸ HDAC6 Q9UBN7 3/20 0.33
▸ HDAC2 Q92769 2/20 0.33
▸ P2RX4 Q99571 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ MAPT P10636 2/20 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
SCHEMBL10064304 0.82 PSMD14 (0.50) PSMD14LMNATP53CYP19A1HDAC1
SCHEMBL13709261 0.77 KDM4E (0.44) KMT2A
SCHEMBL12846413 0.76 KDM4E (0.46) —
SCHEMBL19452419 0.76 KDM4E (0.39) —
SCHEMBL21765759 0.76 CA1 (0.52) CA1CA2CYP19A1HTR6HDAC1
SCHEMBL13589826 0.75 KDM4E (0.36) LMNATP53MAPT
SCHEMBL26058165 0.74 GPR3 (0.39) LMNAMEN1KMT2AMAPT
SCHEMBL10138547 0.74 KDM4E (0.31) —
SCHEMBL17636194 0.73 KDM4E (0.36) —
SCHEMBL19114596 0.73 KDM4E (0.40) KMT2A

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-2012088316-A1 2-ALKYL-5-PHENYL OXADIAZOLE-CARBAZOLE HOSTS FOR GUEST EMITTERS GEORGIA TECH RESEARCH CORPORATION (US) 2012-06-28 — — WO disclosed
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