SCHEMBL16768992

SCHEMBL16768992

Cc1ccc(C2CCC(C3CCC3)CC2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 3/20 0.34
NOTUM Q6P988 1/20 0.33
HPGD P15428 1/20 0.33
ALOX5AP P20292 7/20 0.32
FEN1 P39748 7/20 0.32
HTR2C P28335 3/20 0.32

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
SCHEMBL26802865 1.00 OPRL1 (0.34) OPRL1NOTUMHPGDALOX5APFEN1
SCHEMBL26802888 1.00 OPRL1 (0.34) OPRL1NOTUMHPGDALOX5APFEN1
SCHEMBL26672882 0.96 OPRL1 (0.37) OPRL1NOTUMHPGDALOX5APFEN1
SCHEMBL26672864 0.96 OPRL1 (0.37) OPRL1NOTUMHPGDALOX5APFEN1
SCHEMBL16768989 0.96 OPRL1 (0.37) OPRL1NOTUMHPGDALOX5APFEN1
SCHEMBL16769046 0.96 OPRL1 (0.37) OPRL1NOTUMHPGDALOX5APFEN1
SCHEMBL12018637 0.95 OPRL1 (0.38) OPRL1NOTUMHPGDFEN1HTR2C
SCHEMBL26045594 0.95 OPRL1 (0.38) OPRL1NOTUMHPGDFEN1HTR2C
SCHEMBL26672866 0.94 NOTUM (0.35) OPRL1NOTUMHPGDHTR2C
SCHEMBL26802857 0.94 NOTUM (0.35) OPRL1NOTUMHPGDHTR2C

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
US-20230383186-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-11-30 US disclosed
US-11762241-B2 Device for the regulation of light transmission MERCK PATENT GMBH (DE) 2023-09-19 US disclosed
US-9517990-B2 Negative dielectric anisotropic liquid crystal compounds containing 2,3-difluorophenyl group, and preparation method and use thereof Shijiazhuang Chenzhi Yonghua Display Materials Co., Ltd. (CN) 2016-12-13 US disclosed
US-9428693-B2 Liquid crystal composition having negative dielectric anisotropy SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2016-08-30 US disclosed
US-20150184075-A1 Liquid Crystal Composition Having Negative Dielectric Anisotropy SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2015-07-02 US disclosed
US-20150152330-A1 Negative Dielectric Anisotropic Liquid Crystal Compounds Containing 2,3-Difluorophenyl Group, and Preparation Method and Use Thereof SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2015-06-04 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 (1 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-20150152330-A1 Negative Dielectric Anisotropic Liquid Crystal Compounds Containing 2,3-Difluorophenyl Group, and Preparation Method and Use Thereof CTNND1, YWHAZ, DVL1 OPRL1 2889/4885NOTUM 1928/4885HPGD 4458/4885

“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.