SCHEMBL16996401

SCHEMBL16996401

c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
OPRK1 P41145 1/20 0.40
PDK2 Q15119 14/20 0.39
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
POLB P06746 1/20 0.33
THRB P10828 2/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
XBP1 P17861 1/20 0.33
PTBP1 P26599 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
GALK1 P51570 1/20 0.33
BLM P54132 1/20 0.33

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
SCHEMBL24647557 1.00 MEN1 (0.40) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL16996397 1.00 MEN1 (0.40) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL21924990 0.99 MEN1 (0.39) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL21559117 0.99 MEN1 (0.39) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL25563396 0.99 MAPT (0.39) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL16158332 0.98 MEN1 (0.41) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL16996111 0.98 MEN1 (0.41) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL16158348 0.98 MEN1 (0.41) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL16922933 0.98 MEN1 (0.41) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL16922910 0.98 MEN1 (0.41) MEN1KMT2ALMNAMAPTSMN1; SMN2

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-20150228899-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 US disclosed
US-20150228899-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 US disclosed