SCHEMBL14522095

SCHEMBL14522095

Cc1sc(C)c(C2=C(c3c(C)sc4ccccc34)CCC2)c1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 1/20 0.36
▸ GPR3 P46089 1/20 0.35
▸ CYP1A2 P05177 2/20 0.34
▸ CYP2D6 P10635 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ FTO Q9C0B1 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ FABP4 P15090 1/20 0.33
▸ FABP5 Q01469 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ DRD4 P21917 1/20 0.32
▸ CYP1A1 P04798 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ PRNP P04156 1/20 0.31

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
SCHEMBL5054625 0.92 GPR3 (0.41) PLA2G10GPR3CYP1A2CYP2D6TSHR
SCHEMBL13889738 0.77 MEN1 (0.39) PLA2G10GPR3HSD17B10ALDH1A1MEN1
SCHEMBL13889741 0.76 ALDH1A1 (0.37) GPR3HSD17B10ALDH1A1MEN1KMT2A
SCHEMBL5399445 0.72 MAPT (0.33) HSD17B10ALDH1A1KDM4ELMNAHPGD
SCHEMBL891024 0.72 GPR3 (0.39) PLA2G10GPR3CYP1A2CYP2D6TSHR
SCHEMBL15395405 0.72 PLA2G10 (0.34) PLA2G10GPR3CYP1A2CYP2D6TSHR
SCHEMBL144440 0.71 GPR3 (0.55) GPR3CYP1A2CYP2D6TSHRNFKB1
Ammonia Solution, Strong SCHEMBL28459123 0.69 GPR3 (0.52) GPR3CYP1A2CYP2D6TSHRNFKB1
SCHEMBL5384092 0.69 CYP2A6 (0.35) CYP1A2ALDH1A1DRD4KDM4ELMNA
SCHEMBL12624661 0.69 GPR3 (0.46) PLA2G10GPR3ALDH1A1FABP4FABP5

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
US-20070082291-A1 Lithographic Printing Plate Precursor and Lithographic Printing Method FUJI PHOTO FILM CO., LTD. (JP) 2007-04-12 — — US disclosed
US-20070082291-A1 Lithographic Printing Plate Precursor and Lithographic Printing Method FUJI PHOTO FILM CO., LTD. (JP) 2007-04-12 — — US disclosed
EP-1754614-A1 Lithographic printing plate precursor and lithographic printing method Fuji Photo Film Co., Ltd. (JP) 2007-02-21 — — EP disclosed
Send feedback