SCHEMBL31225168

SCHEMBL31225168

CCCC(C)(C)c1ccc(Oc2ccc(N)cn2)cc1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.69
▸ RAB9A P51151 5/20 0.69
▸ POLB P06746 2/20 0.69
▸ MEN1 O00255 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ MAPT P10636 4/20 0.51
▸ NPC1 O15118 4/20 0.51
▸ ALDH1A1 P00352 3/20 0.46
▸ BRCA1 P38398 1/20 0.46
▸ HBB P68871 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ MAPK1 P28482 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KEAP1 Q14145 1/20 0.40
▸ LMNA P02545 1/20 0.38
▸ GFER P55789 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ LIPE Q05469 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
SCHEMBL15055712 1.00 KDM4E (0.69) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL31225411 0.89 KDM4E (0.73) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL15055437 0.89 KDM4E (0.73) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL31247993 0.84 KDM4E (0.71) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL15054998 0.84 KDM4E (0.71) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL16216732 0.84 RAB9A (0.48) KDM4ERAB9APOLBMEN1KMT2A
Limantrafin SCHEMBL25340427 0.82 KDM4E (1.00) KDM4ERAB9APOLBMEN1KMT2A
Limantrafin SCHEMBL4638726 0.82 KDM4E (1.00) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL30601045 0.82 KDM4E (0.82) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL28064235 0.82 KDM4E (0.82) KDM4ERAB9APOLBMEN1KMT2A

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
EP-3332783-B1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS ECOLE POLYTECHNIQUE FED LAUSANNE EPFL (CH) 2024-12-04 — — EP claimed
CN-119019324-A Process for preparing aminodiaryl ethers and aminodiaryl ether hydrochlorides 塞莱斯蒂亚生物技术股份公司 2024-11-26 — — CN disclosed
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