SCHEMBL20097231

SCHEMBL20097231

CCOc1ccc(Cc2ccc(C3CCC(C)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
KDM1A O60341 2/20 0.33
SCN9A Q15858 1/20 0.31

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
SCHEMBL18012159 0.92 ALDH1A1 (0.36) ALDH1A1KDM1ASCN9A
SCHEMBL12156539 0.92 ALDH1A1 (0.37) ALDH1A1KDM1ASCN9A
SCHEMBL12733628 0.92 ALDH1A1 (0.37) ALDH1A1KDM1ASCN9A
SCHEMBL4406888 0.87 ALDH1A1 (0.38) ALDH1A1KDM1ASCN9A
SCHEMBL15381547 0.87 ALDH1A1 (0.38) ALDH1A1KDM1ASCN9A
SCHEMBL12736607 0.87 NAAA (0.38) ALDH1A1KDM1A
SCHEMBL12740211 0.87 NAAA (0.38) ALDH1A1KDM1A
SCHEMBL12734875 0.86 SCN9A (0.32) ALDH1A1SCN9A
SCHEMBL12739674 0.86 SCN9A (0.32) ALDH1A1SCN9A
SCHEMBL21478420 0.86 ALOX5AP (0.35) ALDH1A1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3670503-B1 COMPOUND, LIQUID CRYSTAL MEDIUM CONTAINING SAME, AND USE THEREOF SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO LTD (CN) 2023-10-18 EP disclosed
US-11208395-B2 Compound, liquid crystal medium containing the compound and application thereof SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2021-12-28 US disclosed
EP-3670503-A1 COMPOUND, LIQUID CRYSTAL MEDIUM CONTAINING SAME, AND USE THEREOF Shijiazhuang Chengzhi Yonghua Display Material Co., Ltd. (CN) 2020-06-24 EP disclosed
US-20190345129-A1 COMPOUND, LIQUID CRYSTAL MEDIUM CONTAINING THE COMPOUND AND APPLICATION THEREOF SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2019-11-14 US disclosed
US-10351773-B2 Liquid crystal compounds of cycloalkyl-containing dibenzofuran derivatives, preparation method therefor and use thereof Shijiazhuang Chengzhi Yonghua Display Material Co., Ltd (CN) 2019-07-16 US disclosed
US-20180112132-A1 LIQUID CRYSTAL COMPOUNDS OF CYCLOALKYL-CONTAINING DIBENZOFURAN DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO.,LTD (CN) 2018-04-26 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 (4 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-20180112132-A1 LIQUID CRYSTAL COMPOUNDS OF CYCLOALKYL-CONTAINING DIBENZOFURAN DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF CYP4F11, WASF2, NOTUM ALDH1A1 640/4885KDM1A 4331/4885SCN9A 4526/4885
US-20190345129-A1 COMPOUND, LIQUID CRYSTAL MEDIUM CONTAINING THE COMPOUND AND APPLICATION THEREOF ABCG2, TPST2, TST ALDH1A1 1687/4885KDM1A 4208/4885SCN9A 3832/4885
US-11208395-B2 Compound, liquid crystal medium containing the compound and application thereof TST, TPST2, ABCG2 ALDH1A1 1604/4885KDM1A 4187/4885SCN9A 3977/4885
US-10351773-B2 Liquid crystal compounds of cycloalkyl-containing dibenzofuran derivatives, preparation method therefor and use thereof CYP4F11, WASF2, NOTUM ALDH1A1 640/4885KDM1A 4331/4885SCN9A 4526/4885

“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.