SCHEMBL17488402

SCHEMBL17488402

Cc1ccc(-c2ccc(OCCO)cc2OCCO)cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 2/20 0.47
▸ FEN1 P39748 2/20 0.47
▸ FFAR4 Q5NUL3 4/20 0.43
▸ FFAR1 O14842 5/20 0.42
▸ AKR1C3 P42330 2/20 0.40
▸ AKR1C2 P52895 2/20 0.40
▸ PDK2 Q15119 1/20 0.39
▸ P2RX7 Q99572 1/20 0.39
▸ AKR1B10 O60218 1/20 0.39
▸ AKR1C4 P17516 1/20 0.39
▸ AKR1C1 Q04828 1/20 0.39
▸ MCL1 Q07820 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ MRGPRX4 Q96LA9 1/20 0.38
▸ PPARD Q03181 2/20 0.38
▸ BCL9 O00512 1/20 0.37
▸ CTNNB1 P35222 1/20 0.37
▸ TLR8 Q9NR97 1/20 0.37
▸ CYP11B1 P15538 1/20 0.37
▸ CYP11B2 P19099 1/20 0.37

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
SCHEMBL17488400 0.86 ALOX5AP (0.47) ALOX5APFEN1FFAR4FFAR1PDK2
SCHEMBL17485690 0.85 MCL1 (0.46) ALOX5APFEN1FFAR4FFAR1MCL1
SCHEMBL17488401 0.83 L3MBTL1 (0.41) FFAR4PDK2MAOACYP11B1CYP11B2
SCHEMBL8258110 0.83 MRGPRX4 (0.49) FFAR4FFAR1PDK2P2RX7MCL1
SCHEMBL17485686 0.79 PTPN11 (0.49) —
SCHEMBL17485688 0.79 ALDH2 (0.51) PDK2MAOA
SCHEMBL18440858 0.78 FFAR1 (0.47) ALOX5APFEN1FFAR1PPARDCYP11B1
SCHEMBL19624543 0.77 CHEK2 (0.42) FFAR4PDK2CYP11B1CYP11B2
SCHEMBL12802944 0.75 PDK2 (0.44) ALOX5APFEN1PDK2MAOACYP11B1
SCHEMBL8257779 0.75 CYP3A4 (0.45) FFAR4FFAR1PDK2P2RX7MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938229-B2 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2018-04-10 — — US disclosed
US-20160032189-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2016-02-04 — — 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-20160032189-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, ILK, LCP1 ALOX5AP 1023/4885FEN1 3541/4885FFAR4 3100/4885

“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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