SCHEMBL7929267

SCHEMBL7929267

COCOc1cccc(-c2ccc(C)cc2)c1C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.39
▸ EGFR P00533 2/20 0.39
▸ DRD1 P21728 2/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ DRD5 P21918 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ LMNA P02545 3/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ BACE1 P56817 2/20 0.35
▸ ADRB2 P07550 1/20 0.35
▸ ERN1 O75460 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KCNN4 O15554 1/20 0.34
▸ CHEK1 O14757 1/20 0.34

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
SCHEMBL7932764 0.83 SYK (0.37) SYKEGFRLMNAMAPK1TDP1
SCHEMBL7932759 0.83 SYK (0.37) SYKEGFRLMNAMAPK1TDP1
SCHEMBL7932563 0.83 ERN1 (0.44) SYKERN1ALDH1A1
SCHEMBL3218241 0.81 PTPN1 (0.42) EGFRTDP1L3MBTL1PTPN1BACE1
SCHEMBL20279251 0.77 ERN1 (0.42) LMNAMAPK1TDP1L3MBTL1PTPN1
SCHEMBL7935210 0.77 SMN1; SMN2 (0.40) LMNAL3MBTL1PTPN1ERN1ALDH1A1
SCHEMBL3205905 0.77 BACE1 (0.45) PTPN1BACE1ERN1ALDH1A1CHEK1
SCHEMBL34462800 0.77 BACE1 (0.45) PTPN1BACE1ERN1ALDH1A1CHEK1
SCHEMBL6683418 0.74 ALDH1A1 (0.40) TDP1L3MBTL1PTPN1BACE1ERN1
SCHEMBL20541205 0.74 ALDH1A1 (0.52) TDP1L3MBTL1PTPN1BACE1ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0879814-B1 Triaromatic compounds, compositions containing them and uses thereof CT INTERNAT DE BR RECH S DERMA (FR) 2001-11-28 — — EP disclosed
US-6150413-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, BONE AND OPHTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS; 4-(4-(BIPHENYL-2-YL)BUT-3-EN-1-YNYL)BENZOIC ACID, FOR EXAMPLE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2000-11-21 — — US disclosed
EP-0879814-A1 Triaromatic compounds, compositions containing them and uses thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-11-25 — — EP disclosed
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