SCHEMBL24808226

SCHEMBL24808226

Cc1nc(C2(C)C=Cc3oc4ccccc4c3C=C2)nc(C2(C)C=Cc3oc4ccccc4c3C=C2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.36
▸ KMT2A Q03164 6/20 0.36
▸ MEN1 O00255 5/20 0.36
▸ HTT P42858 3/20 0.36
▸ KDM4E B2RXH2 5/20 0.34
▸ SMN1; SMN2 Q16637 4/20 0.34
▸ TSHR P16473 2/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.33
▸ RXFP1 Q9HBX9 2/20 0.33
▸ TP53 P04637 2/20 0.33
▸ ALDH1A1 P00352 6/20 0.33
▸ HPGD P15428 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ POLB P06746 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MAPK1 P28482 3/20 0.32
▸ HRH4 Q9H3N8 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32

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
SCHEMBL18698083 0.80 KDM4E (0.36) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL22537996 0.74 KDM4E (0.34) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL23628355 0.72 HSD17B10 (0.32) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL23589780 0.72 KDM4E (0.33) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL10287562 0.71 MAOA (0.47) LMNAKMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL24806811 0.69 — —
SCHEMBL21510644 0.67 HNF4A (0.38) KMT2AMEN1KDM4ETSHRALDH1A1
SCHEMBL20842852 0.65 MAOA (0.33) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL21253832 0.64 ALDH1A1 (0.41) KMT2AKDM4ESMN1; SMN2TP53ALDH1A1
SCHEMBL18711547 0.63 KDM4E (0.35) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1

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-2022267801-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME, AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 2022-12-29 — — WO disclosed
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