SCHEMBL23935985

SCHEMBL23935985

c1ccc(-c2nc(-c3ccc4c(c3)-c3ccccc3C(c3ccccc3)(c3ccccc3)C4(c3ccccc3)c3ccccc3)nc(-c3ccc4ccccc4c3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
ADORA2A P29274 4/20 0.38
ADORA1 P30542 4/20 0.38
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
GSTP1 P09211 1/20 0.35
CYP17A1 P05093 1/20 0.35
CYP19A1 P11511 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
DHFR P00374 1/20 0.35

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
SCHEMBL23936199 0.93 MEN1 (0.44) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL23936479 0.92 MEN1 (0.41) MEN1KMT2AALDH1A1KDM4ETP53
SCHEMBL23935976 0.92 MEN1 (0.42) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL23936257 0.90 MAPT (0.36) MEN1KMT2AALDH1A1KDM4ETP53
SCHEMBL23936231 0.89 MEN1 (0.39) MEN1KMT2AALDH1A1KDM4ETP53
SCHEMBL23936695 0.89 MEN1 (0.41) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL23935992 0.88 MEN1 (0.40) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL23935983 0.87 MEN1 (0.41) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL22059311 0.87 MEN1 (0.44) MEN1KMT2AALDH1A1KDM4ETP53
SCHEMBL23936480 0.86 MEN1 (0.41) MEN1KMT2AALDH1A1KDM4ECYP1A2

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-20210328150-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-21 US disclosed