SCHEMBL22989401

SCHEMBL22989401

CCCCC1(CCCC)c2cc(N)ccc2-c2ccc(C(=O)/C(CCC3CCCCC3)=N/OC(C)=O)cc21

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.34
▸ MAPT P10636 4/20 0.34
▸ ACHE P22303 2/20 0.33
▸ HTR4 Q13639 2/20 0.33
▸ LDLR P01130 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ POLB P06746 1/20 0.30

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
SCHEMBL24490441 0.90 PDK2 (0.35) MEN1KMT2AL3MBTL1TDP1MAPT
SCHEMBL24858669 0.90 MEN1 (0.39) MEN1KMT2AL3MBTL1TDP1MAPT
SCHEMBL20096397 0.86 POLB (0.36) MEN1KMT2AL3MBTL1ALDH1A1POLB
SCHEMBL24490442 0.84 PDK2 (0.36) MEN1KMT2AL3MBTL1TDP1MAPT
SCHEMBL29316858 0.84 MEN1 (0.40) MEN1KMT2AL3MBTL1TDP1MAPT
SCHEMBL22355421 0.82 PDK2 (0.36) KMT2AALDH1A1POLB
SCHEMBL24490437 0.81 PDK2 (0.36) POLB
SCHEMBL24490439 0.81 PDK2 (0.37) MEN1KMT2AL3MBTL1TDP1MAPT
SCHEMBL29317161 0.80 PDK2 (0.36) MEN1KMT2AL3MBTL1TDP1
SCHEMBL22958585 0.79 — —

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
EP-3392232-B1 FLUORENE MULTIFUNCTIONAL PHOTOINITIATOR AND PREPARATION AND USE THEREOF, AND PHOTOSENSITIVE RESIN COMPOSITION CONTAINING FLUORENE PHOTOINITIATOR AND USE THEREOF CHANGZHOU TRONLY ADVANCED ELECTRONIC MAT CO LTD (CN) 2021-02-17 — — EP disclosed
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