SCHEMBL2480692

SCHEMBL2480692

Cc1c(/C=C/C(=O)O)ccc(C(C)C)c1C(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.49
MAPK1 P28482 1/20 0.44
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA4 P22748 3/20 0.39
NFKB1 P19838 1/20 0.39
MIF P14174 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.35
ESR1 P03372 2/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
HCAR2 Q8TDS4 3/20 0.35
HDAC3 O15379 1/20 0.35
TNKS O95271 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 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
SCHEMBL489850 0.87 KDM4E (0.52) KDM4EMAPK1CA1CA2CA4
SCHEMBL5271345 0.80 KDM4E (0.46) KDM4EMAPK1CA1CA2CA4
SCHEMBL1173259 0.79 KDM4E (0.66) KDM4EMAPK1CA1CA2CA4
SCHEMBL18797918 0.78 CA1 (0.52) KDM4EMAPK1CA1CA2CA4
SCHEMBL490186 0.77 KDM4E (0.49) KDM4EMAPK1CA1CA2CA4
SCHEMBL1072586 0.77 KDM4E (0.55) KDM4EMAPK1CA1CA2CA4
SCHEMBL10625737 0.75 TYR (0.39) SMN1; SMN2LMNAALDH1A1THRBTYR
SCHEMBL819054 0.73 CA1 (0.56) KDM4EMAPK1CA1CA2CA4
SCHEMBL28414685 0.73 CA1 (0.56) KDM4EMAPK1CA1CA2CA4
SCHEMBL3141670 0.72 KDM4E (0.57) KDM4EMAPK1CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2874507-B1 AQUEOUS TRANSPARENT OIL-IN-WATER EMULSION COMPRISING AN EMULSIFIED CAROTENOID BASF SE (DE) 2020-12-30 EP claimed
EP-2485807-B1 SUN-CARE COMPOSITIONS ISP INVESTMENTS LLC (US) 2019-07-03 EP claimed
EP-2687103-B1 Process for manufacturing an aqueous transparent oil-in-water emulsion comprising a carotenoid and emulsion produced BASF SE (DE) 2019-05-22 EP claimed
EP-1866033-B1 SUNSCREEN AEROSOL SPRAY ENSIGN LABORATORIES PTY LTD (AU) 2017-04-19 EP claimed
EP-1595936-B1 COMPOSITION FOR EXTERNAL USE VITAMIN C60 BIORES CORP (JP) 2011-10-19 EP claimed
EP-1107728-B1 COSMETIC COMPOSITIONS FOR SOLAR PROTECTION AND USES OREAL (FR) 2004-04-28 EP claimed
EP-1002523-B1 Cosmetic sunscreening compositions OREAL (FR) 2004-03-03 EP claimed
EP-2000123-B1 Stable, low viscosity cosmetic compounds containing esterquat and/or dialkylquat DEB IP LTD (GB) 2015-12-09 EP disclosed
EP-2000123-A1 Stable, low viscosity cosmetic compounds containing esterquat and/or dialkylquat Evonik Goldschmidt GmbH (DE) 2008-12-10 EP disclosed
EP-1844753-A2 Utilisation of ester quats in compositions as sand repellent substances Goldschmidt GmbH (DE) 2007-10-17 EP disclosed
WO-2003084484-A2 COMPOSITION PROVIDING UV PROTECTION BASF AKTIENGESELLSCHAFT (DE) 2003-10-16 WO disclosed