SCHEMBL8009686

SCHEMBL8009686

Cc1[nH]c2ccccc2c1C1(c2c(C)n(C)c3ccccc23)OC(=O)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 4/20 0.40
LMNA P02545 4/20 0.40
NPSR1 Q6W5P4 2/20 0.40
MAPT P10636 8/20 0.40
TP53 P04637 5/20 0.38
CFTR P13569 1/20 0.37
GOPC Q9HD26 1/20 0.37
GAA P10253 3/20 0.36
ALOX12 P18054 2/20 0.36
POLB P06746 2/20 0.36
THRB P10828 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CDK4 P11802 1/20 0.35
CCND1 P24385 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
SCHEMBL31628403 0.89 LMNA (0.49) KDM4EALDH1A1LMNANPSR1MAPT
SCHEMBL3219191 0.89 LMNA (0.49) KDM4EALDH1A1LMNANPSR1MAPT
SCHEMBL3228674 0.87 LMNA (0.50) KDM4EALDH1A1LMNANPSR1MAPT
SCHEMBL9679707 0.86 ALDH1A1 (0.42) KDM4EALDH1A1LMNANPSR1MAPT
SCHEMBL26208115 0.83 KDM4E (0.41) KDM4EALDH1A1NPSR1MAPTTP53
SCHEMBL21443997 0.83 LMNA (0.44) KDM4EALDH1A1LMNANPSR1MAPT
SCHEMBL28348436 0.80 CFTR (0.57) KDM4EALDH1A1LMNANPSR1MAPT
SCHEMBL10937717 0.80 LMNA (0.41) KDM4EALDH1A1LMNANPSR1MAPT
SCHEMBL18900534 0.79 MAPT (0.39) KDM4EALDH1A1LMNANPSR1MAPT
SCHEMBL9773597 0.78 LMNA (0.41) KDM4EALDH1A1LMNANPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000016985-A1 MICROCAPSULES COMPRISING SOLVENT FOR CHROMOGENIC MATERIAL THE MEAD CORPORATION (US) 2000-03-30 WO disclosed
EP-0486745-A1 Improved solvents for chromogens useful in the manufacture of carbonless copying paper MONSANTO EUROPE S.A./N.V. (BE) 1992-05-27 EP disclosed
US-4130299-A AROMATIC HYDROCARBON MONSANTO COMPANY (US) 1978-12-19 US disclosed
US-4124526-A Encapsulation process and resulting aqueous dispersion of encapsulated droplets MONSANTO COMPANY (US) 1978-11-07 US disclosed
US-4093278-A PRESSURE RELEASE ARYL ESTER SOLVENT MONSANTO COMPANY (US) 1978-06-06 US disclosed
US-3979327-A PARTIALLY HYDROGENATED TERPHENYL MONSANTO COMPANY (US) 1976-09-07 US disclosed
US-3979324-A BENZYLNAPHTHALENE COMPOUND MONSANTO COMPANY (US) 1976-09-07 US disclosed
US-3968320-A Dye solvents for pressure-sensitive record material MONSANTO COMPANY (US) 1976-07-06 US disclosed