SCHEMBL3132935

SCHEMBL3132935

CC(=CCCC(O)Cl)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CD81 P60033 2/20 0.39
ALDH1A1 P00352 2/20 0.34
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
PPARG P37231 1/20 0.32
ACLY P53396 1/20 0.32
ACACA Q13085 1/20 0.32
BACE1 P56817 2/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL9004452 0.86 CD81 (0.36) CD81ALDH1A1PPARG
SCHEMBL1401881 0.83 CD81 (0.41) CD81ALDH1A1CYP2D6CYP2C19PPARG
SCHEMBL148010 0.81 CD81 (0.40) CD81ALDH1A1CYP2D6CYP2C19PPARG
SCHEMBL148012 0.81 CD81 (0.40) CD81ALDH1A1CYP2D6CYP2C19PPARG
SCHEMBL27989689 0.79 CD81 (0.36) CD81ALDH1A1CYP2D6CYP2C19PPARG
SCHEMBL986390 0.78 CD81 (0.38) CD81ALDH1A1CYP2D6CYP2C19PPARG
SCHEMBL574289 0.78 KDM1A (0.41) CD81ALDH1A1ACLYACACAALOX15
SCHEMBL1155612 0.78 CD81 (0.34) CD81ALDH1A1
SCHEMBL27628 0.78 KDM1A (0.41) CD81ALDH1A1ACLYACACAALOX15
SCHEMBL245743 0.78 CD81 (0.38) CD81ALDH1A1CYP2D6CYP2C19PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708119-A1 Self-crosslinking, aqueous absorbent polymer compositions AIR PRODUCTS AND CHEMICALS, INC. (US) 1996-04-24 EP claimed
EP-0234724-B1 OIL- AND WATER-REPELLENT COPOLYMERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-31 EP claimed
US-4742140-A FLUROPOLYMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-03 US claimed
US-7643401-B2 Optical information recording medium and stamper HITACHI MAXELL, LTD. (JP) 2010-01-05 US disclosed
US-20060233997-A1 Optical information recording medium and stamper HITACHI MAXELL, LTD. (JP) 2006-10-19 US disclosed
US-20050180305-A1 Optical recording medium MITSUI CHEMICALS , INC (JP) 2005-08-18 US disclosed
EP-0652555-B1 Optical recording medium MITSUI CHEMICALS INC (JP) 2000-07-12 EP disclosed
US-5573831-A ULTRAVIOLET RADIATION CURABLE INK MITSUI TOATSU CHEMICALS, INC. (JP) 1996-11-12 US disclosed
EP-0708119-A1 Self-crosslinking, aqueous absorbent polymer compositions AIR PRODUCTS AND CHEMICALS, INC. (US) 1996-04-24 EP disclosed
EP-0652555-A2 Optical recording medium MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-05-10 EP disclosed
US-5135780-A Electroless deposition from polymer latex containing metal salts by contacting with reducing agent UNION OIL COMPANY OF CALIFORNIA (US) 1992-08-04 US disclosed
US-4596857-A Acrylate ester monomer and polyphosphoric acid polymer soluble in the acrylate monomer, organic peroxide, hardening accelerator OKURA KOGYO KABUSHIKI KAISHA (JP) 1986-06-24 US disclosed
US-4510270-A INCORPORATING A POLYPHOSPHORIC ACID IN A POLYMER; SCREWS OKURA KOGYO KABUSHIKI KAISHA (JP) 1985-04-09 US disclosed