SCHEMBL20100728

SCHEMBL20100728

Fc1ccccc1N(c1ccc(-c2ccc(N(c3ccccc3F)c3ccccc3F)cn2)cc1)c1ccccc1F

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.39
NPC1 O15118 3/20 0.34
RXFP1 Q9HBX9 1/20 0.34
HPGDS O60760 2/20 0.33
LDHA P00338 1/20 0.33
ALOX5AP P20292 5/20 0.33
FEN1 P39748 5/20 0.33
CYP11B2 P19099 1/20 0.33
KCNH2 Q12809 1/20 0.33
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 1/20 0.33
TP53 P04637 1/20 0.32
PKM P14618 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PTPN2 P17706 1/20 0.31
PTPN1 P18031 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
SCHEMBL20100725 0.80 NPC1 (0.34) NPC1RXFP1TP53RAB9ASMN1; SMN2
SCHEMBL15421297 0.75 CYP11B1 (0.50) CYP11B1HPGDSLDHACYP11B2HSD17B1
SCHEMBL2845326 0.72 ALDH1A1 (0.41) SMN1; SMN2HSD17B10
SCHEMBL610726 0.72 CYP11B1 (0.54) CYP11B1NPC1HPGDSLDHACYP11B2
SCHEMBL17402668 0.71 NPC1 (0.49) CYP11B1NPC1HPGDSLDHACYP11B2
SCHEMBL18193958 0.70 APP (0.40) CYP11B1HPGDSLDHAALOX5APFEN1
SCHEMBL19784800 0.70 NPC1 (0.47) CYP11B1NPC1HPGDSLDHACYP11B2
SCHEMBL14298063 0.70 ALDH1A1 (0.35) NPC1RAB9ASMN1; SMN2
SCHEMBL18382278 0.69 CYP11B1 (0.36) CYP11B1NPC1HPGDSLDHACYP11B2
SCHEMBL17465478 0.69 CYP11B1 (0.45) CYP11B1HPGDSLDHACYP11B2HSD17B1

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-20180122587-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-05-03 US disclosed
US-20180122587-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-05-03 US disclosed