SCHEMBL24176159

SCHEMBL24176159

CCCCOc1cccc(C(=O)NCC)c1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.68
USP2 O75604 1/20 0.67
MAPK1 P28482 1/20 0.67
THRB P10828 1/20 0.67
NR1H4 Q96RI1 2/20 0.64
GAA P10253 1/20 0.62
MAPT P10636 1/20 0.62
KAT6A Q92794 1/20 0.60
KMT2A Q03164 4/20 0.59
MEN1 O00255 2/20 0.58
ADRB2 P07550 2/20 0.58
AKR1C2 P52895 1/20 0.57
AKR1C1 Q04828 1/20 0.57
PLA2G4B P0C869 1/20 0.56

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
SCHEMBL14756789 0.87 ITGB3 (0.58) SMPD1USP2MAPK1THRBNR1H4
SCHEMBL24500604 0.87 SMPD1 (0.70) SMPD1USP2MAPK1THRBNR1H4
SCHEMBL13702271 0.86 SMN1; SMN2 (0.63) MAPK1NR1H4MAPTKAT6AKMT2A
SCHEMBL3203062 0.85 GAA (0.62) SMPD1USP2MAPK1THRBNR1H4
SCHEMBL9489684 0.85 SMPD1 (0.76) SMPD1USP2MAPK1THRBNR1H4
SCHEMBL7742636 0.84 GAA (0.65) SMPD1USP2MAPK1THRBNR1H4
SCHEMBL13702418 0.83 SMN1; SMN2 (0.65) SMPD1NR1H4MAPTKMT2AMEN1
SCHEMBL13701712 0.83 LMNA (0.65) SMPD1USP2MAPK1THRBNR1H4
SCHEMBL13754058 0.83 MMP1 (0.70) GAAMAPTKMT2AMEN1
SCHEMBL9402606 0.82 SMPD1 (0.72) SMPD1USP2MAPK1THRBNR1H4

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-11860570-B2 Toner set and image forming method Konica Minolta, Inc. (JP) 2024-01-02 US disclosed
US-20220004113-A1 TONER SET AND IMAGE FORMING METHOD Konica Minolta, Inc. (JP) 2022-01-06 US disclosed