SCHEMBL14232276

SCHEMBL14232276

Cc1ccc(-c2cccc(Oc3cccc(-c4ccccc4)c3)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 4/20 0.58
▸ CYP1A2 P05177 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ FFAR1 O14842 3/20 0.49
▸ ALKBH3 Q96Q83 1/20 0.48
▸ HTT P42858 3/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ GSTP1 P09211 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ABL1 P00519 1/20 0.44
▸ ABCB1 P08183 1/20 0.44
▸ BCR P11274 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ RXRA P19793 1/20 0.44
▸ RXRB P28702 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43

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
SCHEMBL12071804 0.96 FFAR4 (0.57) FFAR4CYP1A2MAPTCYP2C19FFAR1
SCHEMBL13026669 0.88 FFAR4 (0.57) FFAR4CYP1A2MAPTCYP2C19FFAR1
SCHEMBL27601568 0.87 FFAR4 (0.58) FFAR4MAPTFFAR1SMN1; SMN2GSTP1
Diphenylether SCHEMBL9751563 0.87 LTA4H (0.57) FFAR4MAPTFFAR1HTTSMN1; SMN2
SCHEMBL16361075 0.87 LTA4H (0.55) FFAR4CYP1A2MAPTCYP2C19FFAR1
SCHEMBL12071806 0.87 FFAR4 (0.58) FFAR4CYP1A2MAPTCYP2C19FFAR1
SCHEMBL14885946 0.87 ALDH1A1 (0.56) FFAR4FFAR1HTTGSTP1TDP1
SCHEMBL12770833 0.85 ALKBH3 (0.57) FFAR4CYP1A2CYP2C19FFAR1ALKBH3
SCHEMBL10453614 0.85 FFAR4 (0.61) FFAR4MAPTFFAR1SMN1; SMN2GSTP1
SCHEMBL19891793 0.85 FFAR4 (0.61) FFAR4MAPTFFAR1SMN1; SMN2GSTP1

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-20130099171-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2013-04-25 — — US disclosed
US-20120305851-A1 Materials for Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2012-12-06 — — 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 (2 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-20120305851-A1 Materials for Organic Electroluminescent Devices L1CAM, EFNA1, EPCAM FFAR4 4857/4885CYP1A2 343/4885MAPT 1887/4885
US-20130099171-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM FFAR4 4859/4885CYP1A2 390/4885MAPT 1878/4885

“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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