SCHEMBL19921069

SCHEMBL19921069

C=CCOc1ccc(Oc2ccccc2OCC=C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CA12 O43570 5/20 0.46
CA1 P00915 5/20 0.46
CA9 Q16790 5/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
LIG1 P18858 1/20 0.45
ALDH1A1 P00352 3/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 2/20 0.43
SLC22A1 O15245 1/20 0.43
CYP1A2 P05177 1/20 0.43
ADRB2 P07550 1/20 0.43
ADRB1 P08588 1/20 0.43
HTR1A P08908 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL5239038 0.91 TSHR (0.49) MAPK1HPGDTSHRHSD17B10CA12
SCHEMBL3800333 0.86 HPGD (0.55) MAPK1HPGDTSHRHSD17B10CA12
SCHEMBL22215858 0.84 HPGD (0.44) MAPK1HPGDTSHRHSD17B10CA12
1,2-Diallyloxybenzene SCHEMBL366516 0.84 HPGD (0.60) MAPK1HPGDTSHRHSD17B10CA12
1,2-Diallyloxybenzene SCHEMBL29768784 0.84 HPGD (0.60) MAPK1HPGDTSHRHSD17B10CA12
SCHEMBL5973615 0.82 LTA4H (0.55) TSHRCA12CA1CA9CA2
SCHEMBL3487338 0.82 CA12 (0.57) MAPK1CA12CA1CA9CA2
SCHEMBL5757380 0.81 PTGS2 (0.50) MAPK1HPGDTSHRHSD17B10CA12
1,4-Diallyloxybenzene SCHEMBL302448 0.79 CA12 (0.63) MAPK1CA12CA1CA9CA2
SCHEMBL28532068 0.79 KDM4E (0.60) MAPK1HPGDTSHRHSD17B10LIG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20180118672-A1 PROCESS FOR PRODUCING ALLYL-SUBSTITUTED BISPHENOL COMPOUND ACSL3, BRSK1, CCNL2 MAPK1 165/4885HPGD 4139/4885TSHR 3349/4885
US-11773207-B2 Thiol compound, method for synthesizing same, and uses for said thiol compound TST, TMT1A, CTH MAPK1 4198/4885HPGD 718/4885TSHR 3486/4885

“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.