SCHEMBL9718644

SCHEMBL9718644

CC1(C(=O)c2ccccc2)OCOC1c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
MAPT P10636 2/20 0.37
POLB P06746 2/20 0.36
LMNA P02545 1/20 0.36
EPHX1 P07099 1/20 0.36
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
USP2 O75604 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL11245264 0.79 KMT2A (0.43) KMT2ANPSR1L3MBTL1MAPTPOLB
SCHEMBL9004640 0.74 KMT2A (0.40) KMT2ANPSR1L3MBTL1MAPTPOLB
SCHEMBL9793654 0.74 KMT2A (0.40) KMT2ANPSR1L3MBTL1MAPTPOLB
SCHEMBL2404814 0.70 TSHR (0.34) KMT2ANPSR1L3MBTL1MAPTPOLB
SCHEMBL10561225 0.70 KMT2A (0.40) KMT2ANPSR1L3MBTL1MAPTPOLB
SCHEMBL9052323 0.70 LMNA (0.44) KMT2AL3MBTL1MAPTPOLBLMNA
Hydrochloric Acid SCHEMBL9053050 0.68 LMNA (0.43) KMT2AL3MBTL1MAPTPOLBLMNA
SCHEMBL9718676 0.68 LMNA (0.46) KMT2AL3MBTL1MAPTPOLBLMNA
SCHEMBL9004824 0.67 KMT2A (0.46) KMT2ANPSR1L3MBTL1MAPTPOLB
SCHEMBL9793604 0.67 KMT2A (0.46) KMT2ANPSR1L3MBTL1MAPTPOLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5147901-A PROPIONPHENONE DERIVATIVES AS PHOTOINITIATORS FOR PHOTOPOLYMERIZATION CIBA-GEIGY CORPORATION (US) 1992-09-15 US disclosed
EP-0108037-B1 PROPIOPHENONE DERIVATIVES AS PHOTOINITIATORS IN THE PHOTOPOLYMERIZATION CIBA-GEIGY AG (CH) 1989-06-07 EP disclosed
US-4795766-A OF ETHYLENICALLY UNSATURATED COMPOUNDS; PRINTING INK CIBA-GEIGY CORPORATION (US) 1989-01-03 US disclosed
EP-0108037-A2 Propiophenone derivatives as photoinitiators in the photopolymerization CIBA-GEIGY AG (CH) 1984-05-09 EP disclosed