SCHEMBL26363863

SCHEMBL26363863

C=C(Oc1cc2ccccc2cc1OCC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.49
▸ TDP1 Q9NUW8 3/20 0.49
▸ KMT2A Q03164 8/20 0.46
▸ MEN1 O00255 6/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.44
▸ MAPT P10636 8/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ LMNA P02545 5/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ ROCK2 O75116 1/20 0.41
▸ TNKS O95271 1/20 0.41
▸ PARP1 P09874 1/20 0.41
▸ ROCK1 Q13464 1/20 0.41
▸ PARP14 Q460N5 1/20 0.41
▸ PARP10 Q53GL7 1/20 0.41
▸ PARP2 Q9UGN5 1/20 0.41

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
SCHEMBL11643261 0.78 TDP1 (0.53) L3MBTL1TDP1KMT2AMEN1ALDH1A1
SCHEMBL22414714 0.75 ROCK2 (0.53) L3MBTL1TDP1KMT2AMEN1ALDH1A1
SCHEMBL9787048 0.74 L3MBTL1 (0.73) L3MBTL1TDP1KMT2AMEN1ALDH1A1
SCHEMBL31692111 0.73 TDP1 (0.54) L3MBTL1TDP1KMT2AMEN1ALDH1A1
SCHEMBL19668428 0.73 TDP1 (0.54) L3MBTL1TDP1KMT2AMEN1ALDH1A1
SCHEMBL1312768 0.72 PTPN7 (0.72) TDP1KMT2AMEN1KDM4EMAPT
SCHEMBL9925462 0.72 KDM4E (0.68) L3MBTL1KMT2AMEN1KDM4EMAPT
SCHEMBL6224144 0.71 ALDH1A1 (0.73) L3MBTL1TDP1KMT2AMEN1ALDH1A1
SCHEMBL1068092 0.70 MAPT (0.69) L3MBTL1TDP1KMT2AMEN1KDM4E
SCHEMBL9786970 0.70 MAPT (0.74) L3MBTL1TDP1KMT2AMEN1KDM4E

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-4249556-A2 POLYPROPYLENE COPOLYMER COMPOSITION HAVING SUBZERO IMPACT RESISTANCE W.R. Grace & CO. - CONN. (US) 2023-09-27 — — EP disclosed
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