SCHEMBL8982619

SCHEMBL8982619

CCCCC(CC)COc1ccc(C(=O)OC)c(OCC(CC)CCCC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.51
▸ MAPK1 P28482 2/20 0.51
▸ TSHR P16473 2/20 0.51
▸ CYP3A4 P08684 3/20 0.50
▸ CA2 P00918 1/20 0.50
▸ LMNA P02545 2/20 0.46
▸ PRSS1 P07477 1/20 0.45
▸ PRSS2 P07478 1/20 0.45
▸ PRSS3 P35030 1/20 0.45
▸ TDP1 Q9NUW8 3/20 0.45
▸ HSD17B10 Q99714 1/20 0.43
▸ MAOA P21397 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ HDAC3 O15379 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ PLA2G2A P14555 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ HPGD P15428 1/20 0.39

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
SCHEMBL2965158 0.90 LMNA (0.55) ALDH1A1MAPK1TSHRCYP3A4CA2
SCHEMBL8982595 0.87 ALDH1A1 (0.50) ALDH1A1MAPK1TSHRCYP3A4CA2
SCHEMBL4653723 0.86 LMNA (0.54) ALDH1A1MAPK1TSHRCYP3A4CA2
SCHEMBL12436446 0.84 PPARG (0.50) ALDH1A1MAPK1TSHRCYP3A4CA2
SCHEMBL5469285 0.82 ALDH1A1 (0.55) ALDH1A1MAPK1TSHRCYP3A4CA2
SCHEMBL12436449 0.81 KMT2A (0.49) ALDH1A1MAPK1TSHRCYP3A4CA2
SCHEMBL14404535 0.81 TDP1 (0.47) ALDH1A1MAPK1TSHRCYP3A4CA2
SCHEMBL12436440 0.81 KMT2A (0.48) ALDH1A1MAPK1TSHRCYP3A4CA2
SCHEMBL17357488 0.80 TDP1 (0.43) ALDH1A1MAPK1TSHRCYP3A4CA2
SCHEMBL12606083 0.80 ALDH1A1 (0.51) ALDH1A1MAPK1TSHRCYP3A4CA2

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-0423764-B1 Silver halide colour photographic material and cyan coupler of the 2-phenylureido-5-acylaminophenol type FUJI PHOTO FILM CO LTD (JP) 1996-05-08 — — EP disclosed
US-5094938-A High coupling reactivity, high color density FUJI PHOTO FILM CO., LTD. (JP) 1992-03-10 — — US disclosed
EP-0423764-A2 Silver halide colour photographic material and cyan coupler of the 2-phenylureido-5-acylaminophenol type FUJI PHOTO FILM CO., LTD. (JP) 1991-04-24 — — EP disclosed
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