SCHEMBL22010784

SCHEMBL22010784

CCCOc1cc2oc3cc(CCC)c(F)c(F)c3c2c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.34
HMGCR P04035 1/20 0.34
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 4/20 0.33
HPGD P15428 4/20 0.33
MAOB P27338 3/20 0.33
HSD17B10 Q99714 3/20 0.33
CA9 Q16790 2/20 0.33
MAOA P21397 2/20 0.33
ADORA3 P0DMS8 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPT P10636 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 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
SCHEMBL22011095 0.93 PGAM1 (0.38) HMGCRALDH1A1KDM4EHPGDMAOB
SCHEMBL22010799 0.92 PGAM1 (0.39) HMGCRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22011226 0.91 HMGCR (0.36) HMGCRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22011795 0.84 ALDH1A1 (0.38) HMGCRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22011181 0.84 PGAM1 (0.42) ABCB1MAOBCA9MAOAPGAM1
SCHEMBL22010964 0.83 KDM4E (0.37) ALDH1A1KDM4EHPGDHSD17B10ALOX15
SCHEMBL22010811 0.82 KDM4E (0.36) ALDH1A1KDM4EHPGDHSD17B10ALOX15
SCHEMBL22011788 0.79 PGAM1 (0.42) ALDH1A1KDM4EMAOBCA9MAOA
SCHEMBL20828855 0.79 ALDH1A1 (0.40) HMGCRALDH1A1KDM4EHPGDHSD17B10
SCHEMBL22010968 0.78 PGAM1 (0.42) PGAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10662378-B2 Compound having fluorodibenzofuran ring, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2020-05-26 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 (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-10662378-B2 Compound having fluorodibenzofuran ring, liquid crystal composition and liquid crystal display device YBX1, ZKSCAN2, RCC1 ABCB1 1178/4885HMGCR 3852/4885ALDH1A1 577/4885

“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.