SCHEMBL15930402

SCHEMBL15930402

CCn1c(-c2ccc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)cc2)nc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.48
ALDH1A1 P00352 10/20 0.48
HPGD P15428 6/20 0.48
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
HTT P42858 4/20 0.47
NPSR1 Q6W5P4 3/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
GFER P55789 1/20 0.47
KMT2A Q03164 1/20 0.47
NLRP3 Q96P20 1/20 0.41
HSD17B10 Q99714 4/20 0.40
TP53 P04637 3/20 0.40
TSHR P16473 2/20 0.38

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
SCHEMBL15930377 0.92 KDM4E (0.48) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL15930381 0.90 ALDH1A1 (0.42) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL15930401 0.87 ALDH1A1 (0.45) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL15930307 0.86 ESR1 (0.47) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL15930510 0.85 ESR1 (0.46) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL15930388 0.85 ESR1 (0.49) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL15930380 0.85 ESR1 (0.49) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL15930522 0.85 ESR1 (0.49) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL15930315 0.85 ESR2 (0.51) KDM4EALDH1A1HPGDMAPTHTT
SCHEMBL15930387 0.84 ALDH1A1 (0.47) KDM4EALDH1A1HPGDMAPTSMN1; 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-20140217393-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT IDEMITSU KOSAN CO., LTD. 2014-08-07 US disclosed
US-20140217393-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT IDEMITSU KOSAN CO., LTD. 2014-08-07 US disclosed