SCHEMBL30864247

SCHEMBL30864247

Clc1nc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccc3c(c2)oc2ccccc23)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.50
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
ALDH1A1 P00352 5/20 0.41
HPGD P15428 5/20 0.41
MAPT P10636 5/20 0.41
KDM4E B2RXH2 2/20 0.41
MMP12 P39900 1/20 0.41
MMP13 P45452 1/20 0.41
HCRTR1 O43613 1/20 0.39
TTR P02766 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ATM Q13315 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
LMNA P02545 3/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 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
SCHEMBL20894620 1.00 AHR (0.50) AHRMEN1KMT2AALDH1A1HPGD
SCHEMBL29445832 1.00 AHR (0.50) AHRMEN1KMT2AALDH1A1HPGD
SCHEMBL26598936 1.00 AHR (0.50) AHRMEN1KMT2AALDH1A1HPGD
SCHEMBL23437375 0.99 AHR (0.49) AHRMEN1KMT2AALDH1A1HPGD
SCHEMBL29363998 0.98 AHR (0.51) AHRMEN1KMT2AALDH1A1HPGD
SCHEMBL29637769 0.98 AHR (0.51) AHRMEN1KMT2AALDH1A1HPGD
SCHEMBL30343350 0.98 AHR (0.51) AHRMEN1KMT2AALDH1A1HPGD
SCHEMBL19918492 0.98 AHR (0.51) AHRMEN1KMT2AALDH1A1HPGD
SCHEMBL23913788 0.97 AHR (0.50) AHRMEN1KMT2AALDH1A1HPGD
SCHEMBL22130037 0.97 AHR (0.50) AHRMEN1KMT2AALDH1A1HPGD

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
CN-117683047-B Organic compound, organic electroluminescent device and electronic apparatus 陕西莱特光电材料股份有限公司 2024-08-06 CN disclosed
CN-117683047-A Organic compound, organic electroluminescent device and electronic apparatus 陕西莱特光电材料股份有限公司 2024-03-12 CN disclosed