SCHEMBL22011102

SCHEMBL22011102

C=CCCc1ccc(-c2cc3oc4cc(OCC)c(F)c(F)c4c3c(F)c2F)cc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.35
GABRB2 P47870 3/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
LMNA P02545 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
MAOB P27338 2/20 0.32
MAOA P21397 1/20 0.32
TP53 P04637 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
HPGD P15428 1/20 0.31
CYP2D6 P10635 1/20 0.30
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 1/20 0.30

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
SCHEMBL22010955 0.84 RARB (0.40) ALDH1A1MAPTSMN1; SMN2FFAR4LMNA
SCHEMBL22010835 0.83 RARB (0.40) ALDH1A1MAPTSMN1; SMN2FFAR4MEN1
SCHEMBL17123330 0.80 GABRA1 (0.41) GABRA1GABRB2ALDH1A1FFAR4LMNA
SCHEMBL22011081 0.80 MAOB (0.36) GABRA1GABRB2ALDH1A1FFAR4S1PR1
SCHEMBL22011115 0.78 FFAR4 (0.40) ALDH1A1MAPTSMN1; SMN2FFAR4S1PR1
SCHEMBL22011809 0.78
SCHEMBL22277557 0.78 GABRA1 (0.39) GABRA1GABRB2ALDH1A1FFAR4LMNA
SCHEMBL22277605 0.78 GABRA1 (0.39) GABRA1GABRB2ALDH1A1FFAR4LMNA
SCHEMBL22010820 0.78 RARB (0.40) S1PR1
SCHEMBL22010998 0.77 RARB (0.44) ALDH1A1MAPTSMN1; SMN2S1PR1S1PR3

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 GABRA1 3476/4885GABRB2 4075/4885ALDH1A1 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.