SCHEMBL13864490

SCHEMBL13864490

c1cc2cccc3sc4cccc5cccc(sc(c1)c23)c54

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
HSD17B10 Q99714 4/20 0.50
TSHR P16473 4/20 0.50
HPGD P15428 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 2/20 0.50
CYP1A1 P04798 1/20 0.50
CYP1B1 Q16678 1/20 0.50
CA12 O43570 2/20 0.44
CA9 Q16790 2/20 0.44
GPR3 P46089 1/20 0.43
MAPK1 P28482 2/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
THRB P10828 1/20 0.39
CES2 O00748 1/20 0.38
BCHE P06276 1/20 0.38
CES1 P23141 1/20 0.38
MCL1 Q07820 1/20 0.38
TP53 P04637 1/20 0.36

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
SCHEMBL30729663 0.91 ALDH1A1 (0.56) ALDH1A1HSD17B10TSHRHPGDCYP1A2
SCHEMBL1293964 0.91 ALDH1A1 (0.56) ALDH1A1HSD17B10TSHRHPGDCYP1A2
SCHEMBL11907785 0.82 ALDH1A1 (0.46) ALDH1A1HSD17B10TSHRHPGDCYP1A2
SCHEMBL18056006 0.78 ALDH1A1 (0.36) ALDH1A1HSD17B10TSHRHPGDCYP1A2
SCHEMBL18053379 0.78 ALDH1A1 (0.36) ALDH1A1HSD17B10TSHRHPGDCYP1A2
SCHEMBL22988978 0.77 ALDH1A1 (0.40) ALDH1A1HSD17B10TSHRHPGDCYP1A2
SCHEMBL1273963 0.76 ALDH1A1 (0.61) ALDH1A1HSD17B10TSHRHPGDCYP1A2
SCHEMBL23008038 0.75 ALDH1A1 (0.54) ALDH1A1HSD17B10TSHRHPGDCYP1A2
SCHEMBL13936016 0.71 ALDH1A1 (0.54) ALDH1A1HSD17B10TSHRHPGDCYP1A2
SCHEMBL13935888 0.71 ALDH1A1 (0.54) ALDH1A1HSD17B10TSHRHPGDCYP1A2

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-7531298-B2 Silver halide color photosensitive material FUJIFILM CORPORATION (JP) 2009-05-12 US disclosed
US-7531298-B2 Silver halide color photosensitive material FUJIFILM CORPORATION (JP) 2009-05-12 US disclosed