SCHEMBL8670574

SCHEMBL8670574

CCC(C)C1CC(=O)CCC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 5/20 0.33
LMNA P02545 2/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
NR1H4 Q96RI1 1/20 0.30
CTSD P07339 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
SCHEMBL7745359 0.81 L3MBTL1 (0.30) ALDH1A1
SCHEMBL7750053 0.71 GPBAR1 (0.31) GPBAR1CYP3A4NR1H4
SCHEMBL18813492 0.68 AKR1B10 (0.30) GPBAR1
SCHEMBL18813449 0.68 AKR1B10 (0.30) GPBAR1
SCHEMBL19449950 0.66 CYP19A1 (0.37) GPBAR1ALDH1A1CYP3A4
SCHEMBL7749980 0.66 CYP19A1 (0.37) GPBAR1ALDH1A1CYP3A4
SCHEMBL10261126 0.66 CYP19A1 (0.37) GPBAR1ALDH1A1CYP3A4
SCHEMBL14873988 0.66 CYP19A1 (0.32)
SCHEMBL4740676 0.66 THRB (0.36) ALDH1A1CYP3A4
SCHEMBL16093970 0.65 SHBG (0.41) GPBAR1KMT2AALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-0402678-B1 Polycarbonate mixtures for optical devices BAYER AG (DE) 1995-11-02 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-0416404-B1 Polycarbonates containing UV-absorbents BAYER AG (DE) 1994-10-12 EP disclosed
EP-0614769-A1 Direct thermal imaging material containing a protective layer AGFA-GEVAERT N.V. (BE) 1994-09-14 EP disclosed
EP-0402678-A2 Polycarbonate mixtures for optical devices BAYER AG (DE) 1990-12-19 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
EP-0362646-A2 Mixture of special polycarbonates and other thermoplasts or elastomers BAYER AG (DE) 1990-04-11 EP disclosed
EP-0359953-A1 Dihydroxydiphenylcycloalkanes, their preparation and their use for the preparation of high molecular polycarbonates BAYER AG (DE) 1990-03-28 EP disclosed