SCHEMBL3487338

SCHEMBL3487338

C=CCOc1ccc(Oc2ccc(OCC=C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.57
CA1 P00915 5/20 0.57
CA9 Q16790 5/20 0.57
CA2 P00918 1/20 0.57
CA7 P43166 1/20 0.57
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP2D6 P10635 1/20 0.46
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
ALDH1A1 P00352 3/20 0.45
GAA P10253 2/20 0.45
KDM4E B2RXH2 1/20 0.45

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
1,4-Diallyloxybenzene SCHEMBL302448 0.92 CA12 (0.63) CA12CA1CA9CA2CA7
SCHEMBL5973615 0.91 LTA4H (0.55) CA12CA1CA9CA2CA7
SCHEMBL5773100 0.89 ALDH1A1 (0.56) CA12CA1CA9CA2CA7
SCHEMBL5973047 0.89 CA12 (0.49) CA12CA1CA9CA2CA7
SCHEMBL3548978 0.89 HPGD (0.49) CA12CA1CA9CA2CA7
SCHEMBL5208927 0.89 CA12 (0.49) CA12CA1CA9CA2CA7
SCHEMBL3416077 0.89 LTA4H (0.57) CA12CA1CA9CA2CA7
SCHEMBL28922902 0.88 CA12 (0.47) CA12CA1CA9CA2CA7
SCHEMBL22215859 0.86 MEN1 (0.47) CA12CA1CA9CA2CA7
SCHEMBL3971632 0.86 CA12 (0.50) CA12CA1CA9CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056475-A1 CYCLODEXTRIN CONJUGATES RGO BIOSCIENCE LLC 2010-03-04 US claimed
WO-2010017328-A2 CYCLODEXTRIN CONJUGATES RGO BIOSCIENCES LLC (US) 2010-02-11 WO claimed
JP-1110649-A None JP disclosed
US-11773207-B2 Thiol compound, method for synthesizing same, and uses for said thiol compound SHIKOKU CHEMICALS CORPORATION (JP) 2023-10-03 US disclosed
US-11773207-B2 Thiol compound, method for synthesizing same, and uses for said thiol compound SHIKOKU CHEMICALS CORPORATION (JP) 2023-10-03 US disclosed
WO-2020145111-A1 THIOL COMPOUND, METHOD FOR SYNTHESIZING SAME, AND USES FOR SAID THIOL COMPOUND 四国化成工業株式会社 2020-07-16 WO disclosed
EP-3290402-B1 PROCESS FOR PRODUCING ALLYL-SUBSTITUTED BISPHENOL COMPOUND NICCA CHEMICAL CO (JP) 2019-11-20 EP disclosed
US-9963426-B1 Process for producing allyl-substituted bisphenol compound NICCA CHEMICAL CO., LTD. (JP) 2018-05-08 US disclosed
US-20180118672-A1 PROCESS FOR PRODUCING ALLYL-SUBSTITUTED BISPHENOL COMPOUND NICCA CHEMICAL CO., LTD. (JP) 2018-05-03 US disclosed
EP-3290402-A1 PROCESS FOR PRODUCING ALLYL-SUBSTITUTED BISPHENOL COMPOUND Nicca Chemical Co., Ltd. (JP) 2018-03-07 EP disclosed
US-9704997-B2 Photopatternable materials and related electronic devices and methods FLEXTERRA, INC. (US) 2017-07-11 US disclosed
US-20100056475-A1 CYCLODEXTRIN CONJUGATES RGO BIOSCIENCE LLC 2010-03-04 US disclosed
WO-2010017328-A2 CYCLODEXTRIN CONJUGATES RGO BIOSCIENCES LLC (US) 2010-02-11 WO disclosed
EP-0441047-B1 Thermosettable composition MINNESOTA MINING & MFG (US) 1996-06-05 EP disclosed
US-5462996-A Providing a composition with low viscosity for compounding but having an increase in viscosity at cure temperatures MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-10-31 US disclosed
US-5405686-A Woven and non-woven web, film or foil; prepregs; polyepoxides, polyetherimides, blends MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-04-11 US disclosed
US-5368922-A Polymer and fiber blends for hot melt compositions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-11-29 US disclosed
US-5276106-A Decreasing viscosity with increasing temperature up to dissolution temperature, then increasing viscosity with temperature, rheology control MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-01-04 US disclosed
EP-0441047-A2 Thermosettable composition MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-08-14 EP disclosed
JP-H01110649-A ALLYLPHENOL DERIVATIVE CHISSO CORP 1989-04-27 JP 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 (3 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-20100056475-A1 CYCLODEXTRIN CONJUGATES CLTC, CDV3, CLINT1 CA12 255/4885CA1 631/4885CA9 559/4885
US-20180118672-A1 PROCESS FOR PRODUCING ALLYL-SUBSTITUTED BISPHENOL COMPOUND ACSL3, BRSK1, CCNL2 CA12 2475/4885CA1 2639/4885CA9 1532/4885
US-11773207-B2 Thiol compound, method for synthesizing same, and uses for said thiol compound TST, TMT1A, CTH CA12 2561/4885CA1 1231/4885CA9 2520/4885

“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.