SCHEMBL5704306

SCHEMBL5704306

C=C(CC)c1ccc(C)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
LMNA P02545 2/20 0.44
CES2 O00748 2/20 0.44
CES1 P23141 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
GSK3B P49841 1/20 0.41
TDP1 Q9NUW8 3/20 0.40
ACHE P22303 2/20 0.40
KMT2A Q03164 3/20 0.39
PKM P14618 2/20 0.39
HTT P42858 2/20 0.39
ATM Q13315 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MEN1 O00255 2/20 0.39
HPGD P15428 1/20 0.39
NLRP1 Q9C000 1/20 0.39
GAA P10253 1/20 0.39
NTSR1 P30989 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL2263489 0.89 NR1I2 (0.42) ALDH1A1LMNASMN1; SMN2ACHEKMT2A
SCHEMBL16442727 0.88 MMP13 (0.49) ALDH1A1LMNASMN1; SMN2TDP1KMT2A
SCHEMBL8410387 0.85 SLC6A4 (0.36) ALDH1A1LMNASMN1; SMN2ACHEKMT2A
SCHEMBL7197697 0.81 ALDH1A1 (0.41) ALDH1A1LMNACES2CES1SMN1; SMN2
SCHEMBL295411 0.80 ALDH1A1 (0.44) ALDH1A1LMNACES2CES1SMN1; SMN2
SCHEMBL5749794 0.80 ESR1 (0.58) ALDH1A1LMNASMN1; SMN2TDP1ACHE
SCHEMBL28445165 0.80 GSK3B (0.58) ALDH1A1LMNACES2CES1SMN1; SMN2
SCHEMBL5178198 0.78 MAOA (0.47) ALDH1A1CES2CES1SMN1; SMN2GSK3B
SCHEMBL11698205 0.78 CYP19A1 (0.54) ALDH1A1LMNATDP1KMT2AMEN1
SCHEMBL2015853 0.78 MAOA (0.55) ALDH1A1LMNACES2CES1GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114874392-A Preparation method of ACS resin 长春工业大学 2022-08-09 CN claimed
US-6534595-B2 Blend of thermosetting resin, decomposable resin and solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-18 US claimed
US-20010038887-A1 Coating solution for forming porous organic film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-08 US claimed
US-4956123-A REACTING A STYRENE TYPE COMPOUND WITH A DIHALOACYL PEROXIDE TO MAKE A FLUOROALKYLAROMATIC ESTER NIPPON OILS & FATS COMPANY, LTD. (JP) 1990-09-11 US claimed
EP-0189275-B1 METHOD FOR MANUFACTURE OF FLUORINE-CONTAINING AROMATIC DERIVATIVES NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-10-18 EP claimed
US-4709109-A Preparation of alkenylaromatics BASF AKTIENGESELLSCHAFT (DE) 1987-11-24 US claimed
EP-0189275-A2 Method for manufacture of fluorine-containing aromatic derivatives NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1986-07-30 EP claimed
CN-114874392-A Preparation method of ACS resin 长春工业大学 2022-08-09 CN disclosed
EP-2984055-B1 PREPARATION OF SURFACTANTS VIA CROSS-METATHESIS MATERIA INC (US) 2018-10-17 EP disclosed
US-9758445-B2 Preparation of surfactants via cross-metathesis MATERIA, INC. (US) 2017-09-12 US disclosed
US-9663459-B2 Preparation of surfactants via cross-metathesis MATERIA, INC. (US) 2017-05-30 US disclosed
US-20160186094-A1 PREPARATION OF SURFACTANTS VIA CROSS-METATHESIS MATERIA, INC. 2016-06-30 US disclosed
US-20160145204-A1 PREPARATION OF SURFACTANTS VIA CROSS-METATHESIS MATERIA, INC. 2016-05-26 US disclosed
EP-0219092-A1 Process for preparing alkenylaromatic compounds BASF Aktiengesellschaft (DE) 1987-04-22 EP disclosed
EP-0189275-A2 Method for manufacture of fluorine-containing aromatic derivatives NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1986-07-30 EP disclosed
US-4598124-A GRAFT POLYMERIZATION MONSANTO COMPANY (US) 1986-07-01 US disclosed
US-4417030-A SEPARATELY CHARGING RUBBER DISSOLVED IN ALKENYL AROMATIC MONOMER AND ALKENYL NITRILE MONSANTO COMPANY (US) 1983-11-22 US disclosed
EP-0067536-A1 Mass polymerization process for ABS polyblends MONSANTO COMPANY (US) 1982-12-22 EP disclosed
US-4198535-A HEATING WITH SILICA-ALUMINA CATALYST MITSUI PETROCHEMICAL INDUSTRIES LTD. (JP) 1980-04-15 US disclosed
US-3946081-A OXIDATION CATALYSTS, GROUP V, VI, OR VII OXIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-03-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160186094-A1 PREPARATION OF SURFACTANTS VIA CROSS-METATHESIS SMURF2, EPHX2, SMURF1 ALDH1A1 1887/4885LMNA 1872/4885CES2 249/4885
US-20160145204-A1 PREPARATION OF SURFACTANTS VIA CROSS-METATHESIS SMURF2, SMURF1, ABCB4 ALDH1A1 3135/4885LMNA 1327/4885CES2 378/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.