SCHEMBL5463105

SCHEMBL5463105

C/C=C\c1cc(C)cc(C(C)(C)C)c1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 3/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ POLB P06746 1/20 0.61
▸ TYR P14679 1/20 0.61
▸ HSPA5 P11021 1/20 0.50
▸ CYP2C9 P11712 3/20 0.49
▸ CYP2C19 P33261 3/20 0.49
▸ HIF1A Q16665 2/20 0.49
▸ PTGS1 P23219 2/20 0.46
▸ PTGS2 P35354 2/20 0.46
▸ CYP2D6 P10635 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ CA1 P00915 2/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ GABBR2 O75899 2/20 0.40
▸ GABBR1 Q9UBS5 2/20 0.40
▸ ERN1 O75460 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ HPN P05981 1/20 0.37

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
SCHEMBL5463108 1.00 CA2 (0.61) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL5464965 0.81 PTGS2 (0.45) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL5464969 0.81 PTGS2 (0.45) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL311105 0.79 ERN1 (0.67) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL30646074 0.79 ERN1 (0.67) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL25176859 0.78 PTGS1 (0.55) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL23544061 0.78 ALDH1A1 (0.61) CA2SMN1; SMN2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL3950 0.77 SMN1; SMN2 (1.00) CA2SMN1; SMN2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL453824 0.77 SMN1; SMN2 (1.00) CA2SMN1; SMN2ALDH1A1POLBTYR
SCHEMBL11338030 0.76 SMN1; SMN2 (0.59) CA2SMN1; SMN2ALDH1A1POLBTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995000557-A1 THIOL-ENE COMPOSITIONS WITH IMPROVED CURE SPEED RETENTION LOCTITE CORPORATION (US) 1995-01-05 — — WO claimed
US-5371181-A Contacting p(olythiol with ammphoteric treating agent, mixing with polyene and shelf life stabilizer comprosing hydroxyl-amine salt LOCTITE CORPORATION (US) 1994-12-06 — — US claimed
US-12129320-B2 Materials for reducing acids from liquid phases THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2024-10-29 — — US disclosed
US-20240052080-A1 MATERIALS FOR REDUCING ACIDS FROM LIQUID PHASES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA 2024-02-15 — — US disclosed
US-20220056181-A1 MATERIALS FOR REDUCING ACIDS FROM LIQUID PHASES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA 2022-02-24 — — US disclosed
US-20210395923-A1 PHOTOPOLYMERIZABLE COMPOSITIONS FOR SOLVENTLESS FIBER SPINNING BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2021-12-23 — — US disclosed
US-10221503-B2 Photopolymerizable compositions for solventless fiber spinning BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-03-05 — — US disclosed
US-9162191-B2 Imidazole-containing polymer membranes and methods of use BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2015-10-20 — — US disclosed
US-20140130416-A1 Imidazole-Containing Polymer Membranes and Methods of Use BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2014-05-15 — — US disclosed
US-20140039150-A1 PHOTOPOLYMERIZABLE COMPOSITIONS FOR SOLVENTLESS FIBER SPINNING BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-02-06 — — US disclosed
WO-2012138960-A1 PHOTOPOLYMERIZABLE COMPOSITIONS FOR SOLVENTLESS FIBER SPINNING BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2012-10-11 — — WO disclosed
EP-0656030-B1 STABILIZER SYSTEM FOR THIOL-ENE AND THIOL-NENE COMPOSITIONS LOCTITE CORP (US) 2000-07-12 — — EP disclosed
US-5558937-A NORBORNENE-THIOL-OXYBUTYLENE POLYMER LOCTITE CORPORATION (US) 1996-09-24 — — US disclosed
EP-0656030-A4 STABILIZER SYSTEM FOR THIOL-ENE AND THIOL-NENE COMPOSITIONS. LOCTITE CORP (US) 1995-12-13 — — EP disclosed
US-5459173-A Heat resistant stabilizers LOCTITE CORPORATION (US) 1995-10-17 — — US disclosed
EP-0656030-A1 STABILIZER SYSTEM FOR THIOL-ENE AND THIOL-NENE COMPOSITIONS LOCTITE CORPORATION (US) 1995-06-07 — — EP disclosed
WO-1995000869-A1 OPTICAL FIBER PRIMARY COATINGS AND FIBERS COATED THEREWITH LOCTITE CORPORATION (US) 1995-01-05 — — WO disclosed
WO-1995000579-A1 STABILIZER SYSTEM FOR THIOL-ENE AND THIOL-NENE COMPOSITIONS LOCTITE CORPORATION (US) 1995-01-05 — — WO disclosed
WO-1995000557-A1 THIOL-ENE COMPOSITIONS WITH IMPROVED CURE SPEED RETENTION LOCTITE CORPORATION (US) 1995-01-05 — — WO disclosed
US-5371181-A Contacting p(olythiol with ammphoteric treating agent, mixing with polyene and shelf life stabilizer comprosing hydroxyl-amine salt LOCTITE CORPORATION (US) 1994-12-06 — — 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-20240052080-A1 MATERIALS FOR REDUCING ACIDS FROM LIQUID PHASES TTPA, EMD, PPIP5K2 CA2 914/4885SMN1; SMN2 3986/4885ALDH1A1 2354/4885
US-12129320-B2 Materials for reducing acids from liquid phases TTPA, EMD, PPIP5K2 CA2 914/4885SMN1; SMN2 3986/4885ALDH1A1 2354/4885

“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.

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