SCHEMBL19681499

SCHEMBL19681499

Fc1cccc2c1COc1c(F)cccc1-2

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PGR P06401 7/20 0.51
CYP19A1 P11511 2/20 0.41
ADRA2A P08913 1/20 0.39
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
TERT O14746 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
AR P10275 4/20 0.33
NR3C1 P04150 3/20 0.33
SRD5A1 P18405 1/20 0.33
HTR2C P28335 1/20 0.32
HTR7 P34969 1/20 0.32
PARP1 P09874 1/20 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
SCHEMBL13248018 0.81 PGR (0.47) PGRCYP19A1ADRA2AESR1ESR2
SCHEMBL856025 0.78 MAOB (0.47) CYP19A1SRD5A1
SCHEMBL30779660 0.76 PARP1 (0.54) PGRCYP19A1ADRA2ATERTPARP1
SCHEMBL18331030 0.76 PARP1 (0.54) PGRCYP19A1ADRA2ATERTPARP1
SCHEMBL30715532 0.73 CYP19A1 (0.40) PGRCYP19A1ADRA2ATERTPARP1
SCHEMBL30989916 0.72 CYP19A1 (0.39) PGRCYP19A1ADRA2ATERTPARP1
SCHEMBL5684576 0.71 PGR (0.47) PGRCYP19A1NOS3NOS2DRD2
SCHEMBL29517854 0.71 PGR (0.47) PGRCYP19A1NOS3NOS2DRD2
SCHEMBL9740321 0.69 MAOA (0.52) CYP19A1
SCHEMBL24727216 0.68 POLB (0.37) PGRAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954445-B2 Liquid crystal composition SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2021-03-23 US disclosed
US-10858591-B2 Stabilizer and liquid crystal composition comprising same SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2020-12-08 US disclosed
US-10767113-B2 Liquid crystal compound containing 2,3,4-trisubstituted benzene and composition thereof SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2020-09-08 US disclosed
US-10759997-B2 Polymerizable compound, liquid crystal medium containing same and liquid crystal display device SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2020-09-01 US disclosed
US-10472570-B2 Highly vertical dielectric liquid crystal compound, liquid crystal composition, and liquid crystal display device SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2019-11-12 US disclosed
US-20190100697-A1 LIQUID CRYSTAL COMPOSITION SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2019-04-04 US disclosed
US-20180119012-A1 HIGHLY VERTICAL DIELECTRIC LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2018-05-03 US disclosed
US-20180094191-A1 LIQUID CRYSTAL COMPOUND CONTAINING 2,3,4-TRISUBSTITUTED BENZENE AND COMPOSITION THEREOF SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO LTD (CN) 2018-04-05 US disclosed
US-20170349833-A1 STABILIZER AND LIQUID CRYSTAL COMPOSITION COMPRISING SAME SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2017-12-07 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 (5 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-10858591-B2 Stabilizer and liquid crystal composition comprising same BCL2L2, NCAPD2, ZYX PGR 3767/4885CYP19A1 2984/4885ADRA2A 2973/4885
US-20170349833-A1 STABILIZER AND LIQUID CRYSTAL COMPOSITION COMPRISING SAME LBR, CTNND1, CRYZ PGR 3847/4885CYP19A1 3006/4885ADRA2A 1025/4885
US-20180119012-A1 HIGHLY VERTICAL DIELECTRIC LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CCNB1, FLNB, CXCR1 PGR 2213/4885CYP19A1 161/4885ADRA2A 1831/4885
US-10472570-B2 Highly vertical dielectric liquid crystal compound, liquid crystal composition, and liquid crystal display device CCNB1, FLNB, CXCR1 PGR 2213/4885CYP19A1 161/4885ADRA2A 1831/4885
US-10759997-B2 Polymerizable compound, liquid crystal medium containing same and liquid crystal display device BPHL, KLK3, NEFM PGR 1194/4885CYP19A1 434/4885ADRA2A 4750/4885

“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.