SCHEMBL22011779

SCHEMBL22011779

CCCCCOc1cc(O)cc(F)c1F

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PGAM1 P18669 2/20 0.45
▸ NR5A1 Q13285 1/20 0.43
▸ GPR84 Q9NQS5 2/20 0.43
▸ ALOX5 P09917 4/20 0.41
▸ LTA4H P09960 1/20 0.41
▸ PTGS2 P35354 6/20 0.41
▸ THRA P10827 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ CYP3A4 P08684 1/20 0.39
▸ SMPD1 P17405 1/20 0.38

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
SCHEMBL28779648 0.95 PGAM1 (0.45) PGAM1NR5A1GPR84ALOX5LTA4H
SCHEMBL29742157 0.95 PGAM1 (0.45) PGAM1NR5A1GPR84ALOX5LTA4H
SCHEMBL28877162 0.80 ALOX5 (0.49) PGAM1NR5A1GPR84ALOX5LTA4H
SCHEMBL25797619 0.78 THRA (0.54) NR5A1ALOX5LTA4HTHRATHRB
SCHEMBL9641086 0.78 THRA (0.54) NR5A1ALOX5LTA4HTHRATHRB
SCHEMBL25797639 0.75 NR5A1 (0.54) NR5A1GPR84LTA4H
SCHEMBL8067639 0.74 L3MBTL1 (0.42) LTA4HTHRATHRB
SCHEMBL18487563 0.74 LTA4H (0.49) NR5A1ALOX5LTA4HTHRATHRB
SCHEMBL29742352 0.74 GLA (0.39) THRATHRB
SCHEMBL20819709 0.74 CCNB2 (0.38) THRATHRB

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 PGAM1 4829/4885NR5A1 3224/4885GPR84 3493/4885

“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.

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