SCHEMBL7745391

SCHEMBL7745391

CC(C)C1CC(C)(C)CC1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.46
ALDH1A1 P00352 9/20 0.38
TSHR P16473 3/20 0.38
POLB P06746 2/20 0.38
KDM4E B2RXH2 2/20 0.38
KMT2A Q03164 5/20 0.34
HTT P42858 1/20 0.34
MEN1 O00255 2/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP2C9 P11712 3/20 0.33
CYP2C19 P33261 2/20 0.33
CYP3A4 P08684 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 2/20 0.32
HIF1A Q16665 1/20 0.32
TLR4 O00206 2/20 0.32

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
SCHEMBL18105776 0.78 MAPT (0.39) MAPTALDH1A1TSHRPOLBKDM4E
SCHEMBL18105664 0.78 MAPT (0.39) MAPTALDH1A1TSHRPOLBKDM4E
SCHEMBL24521956 0.75 MAPT (0.36) MAPTALDH1A1TSHRPOLBKDM4E
SCHEMBL10445687 0.72 MAPT (0.42) MAPTALDH1A1TSHRPOLBKDM4E
SCHEMBL569284 0.71
SCHEMBL108518 0.69
SCHEMBL21247206 0.69
SCHEMBL22236895 0.68 TSHR (0.32) TSHR
SCHEMBL11450684 0.67 TLR4 (0.32) TLR4
SCHEMBL19830731 0.67 MAPT (0.36) MAPTALDH1A1TSHRPOLBKDM4E

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0770589-B1 Process for the preparation of bisphenols using new co-catalysts BAYER AG (DE) 2001-01-10 EP disclosed
US-5759752-A TRANSPARENT POLYCARBONATE AGFA-GEVAERT N.V. (BE) 1998-06-02 US disclosed
US-5698600-A Process for the production of bisphenols with the use of new cocatalysts BAYER AG (DE) 1997-12-16 US disclosed
EP-0770589-A2 Process for the preparation of bisphenols using new co-catalysts BAYER AG (DE) 1997-05-02 EP disclosed
EP-0614769-B1 Direct thermal imaging material containing a protective layer AGFA GEVAERT NV (BE) 1996-09-25 EP disclosed
EP-0573086-B1 Dye-donor element for use according to thermal dye sublimation transfer AGFA GEVAERT NV (BE) 1996-03-13 EP disclosed
EP-0523474-B1 Dye receiving sheet for the thermosublimation printing process AGFA GEVAERT AG (DE) 1995-09-20 EP disclosed
US-5378676-A Thermal dye transfer, polycarbonate binder derived from a bis(hydroxyphenyl)-cyclohexane or cyclopentane AGFA-GEVAERT, N.V. (BE) 1995-01-03 US disclosed
US-5372986-A Heat resistant layer containing a polyether AGFA-GEVAERT, N.V. (BE) 1994-12-13 US disclosed
EP-0614769-A1 Direct thermal imaging material containing a protective layer AGFA-GEVAERT N.V. (BE) 1994-09-14 EP disclosed
EP-0417462-A1 Films from polyarylene sulfide mixtures and their use for gas separation BAYER AG (DE) 1991-03-20 EP disclosed
EP-0413222-A2 Polyarylene sulfide resin composition BAYER AG (DE) 1991-02-20 EP disclosed
EP-0410221-A2 Flame retardant compositions BAYER AG (DE) 1991-01-30 EP disclosed
EP-0400409-A2 Aromatic copolyetherketones BAYER AG (DE) 1990-12-05 EP disclosed
EP-0393454-A2 Heat-resistant polycarbonate moulding composition BAYER AG (DE) 1990-10-24 EP disclosed
US-4964890-A GAS-PERMEABLE FILMS OF A THERMOPLASTIC POLYETHER HAVING DIHYDROXYBENZOPHENONE AND DIHYDROXYDIPHENYLCYCLOALKANE UNITS; DIMENSIONAL STABILITY; HEAT RESISTANCE; MEMBRANES BAYER AKTIENGESELLSCHAFT (DE) 1990-10-23 US disclosed
EP-0365917-A1 Polymer mixtures BAYER AG (DE) 1990-05-02 EP disclosed
EP-0365916-A1 Polymer mixtures BAYER AG (DE) 1990-05-02 EP disclosed
EP-0364741-A1 Aromatic polyetherketones BAYER AG (DE) 1990-04-25 EP disclosed
EP-0362603-A1 Aromatic Polyethersulfones BAYER AG (DE) 1990-04-11 EP disclosed