SCHEMBL4797459

SCHEMBL4797459

CCCCCCCCCCOC(=O)c1ccccc1C(=O)OC(CC)CCCCC

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.71
▸ TSHR P16473 5/20 0.71
▸ LMNA P02545 4/20 0.71
▸ CYP3A4 P08684 3/20 0.68
▸ MAPK1 P28482 3/20 0.68
▸ TP53 P04637 1/20 0.68
▸ L3MBTL1 Q9Y468 3/20 0.61
▸ TDP1 Q9NUW8 2/20 0.61
▸ PRSS1 P07477 1/20 0.60
▸ PRSS2 P07478 1/20 0.60
▸ PRSS3 P35030 1/20 0.60
▸ KDM4E B2RXH2 3/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ POLB P06746 1/20 0.59
▸ CA2 P00918 1/20 0.52
▸ MAPT P10636 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ CNR2 P34972 1/20 0.45

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
SCHEMBL29447731 1.00 ALDH1A1 (0.71) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL9350620 0.96 TSHR (0.68) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL27937622 0.95 ALDH1A1 (0.75) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL29447720 0.93 ALDH1A1 (0.73) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL27163539 0.93 ALDH1A1 (0.60) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL29447771 0.92 ALDH1A1 (0.71) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL1007039 0.92 ALDH1A1 (0.63) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL7909412 0.92 ALDH1A1 (0.63) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL9350600 0.92 ALDH1A1 (0.63) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL8021123 0.92 ALDH1A1 (0.63) ALDH1A1TSHRLMNACYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7378373-B2 Color former, developer, binder resin, and plasticizer; improved performance KABUSHIKI KAISHA TOSHIBA (JP) 2008-05-27 — — US disclosed
CN-101144992-A Erasable image forming material and manufacturing method thereof TOSHIBA KK (JP) 2008-03-19 — — CN disclosed
US-20070072771-A1 ERASABLE IMAGE FORMING MATERIAL KABUSHIKI KAISHA TOSHIBA (JP) 2007-03-29 — — US disclosed
US-5326796-A Use of an arylsulphonylurethane as film forming resin in nitrocellulose nail varnishes, new arylsulphonylurethanes and new nitrocellulose nail varnishes SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1994-07-05 — — US disclosed
US-4536467-A Heat development of silver halide element with redox dye releaser and stabilizer FUJI PHOTO FILM CO., LTD. (JP) 1985-08-20 — — US disclosed
Send feedback