SCHEMBL26299786

SCHEMBL26299786

O=C1CC(=S)c2cc(-c3ccccc3)sc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTP4A3 O75365 3/20 0.49
PTP4A2 Q12974 2/20 0.47
PTP4A1 Q93096 2/20 0.47
HSD17B1 P14061 2/20 0.43
HSD17B2 P37059 1/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1B1 Q16678 1/20 0.38
RAB9A P51151 4/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
LMNA P02545 3/20 0.37
NPC1 O15118 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PRKDC P78527 1/20 0.35
ESR1 P03372 3/20 0.35
ESR2 Q92731 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
RXFP1 Q9HBX9 2/20 0.35

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
SCHEMBL26299788 0.87 PTP4A3 (0.49) PTP4A3PTP4A2PTP4A1HSD17B1HSD17B2
SCHEMBL26299776 0.74 PTP4A3 (0.46) PTP4A3PTP4A2PTP4A1HSD17B1HSD17B2
SCHEMBL26299772 0.70
SCHEMBL26299745 0.70 PTGS2 (0.30)
SCHEMBL26299758 0.70
SCHEMBL20278942 0.70 PTP4A3 (0.48) PTP4A3PTP4A2PTP4A1HSD17B1HSD17B2
SCHEMBL9755135 0.69 HSD17B1 (0.70) PTP4A3PTP4A2PTP4A1HSD17B1HSD17B2
SCHEMBL26299777 0.68 PTP4A3 (0.43) PTP4A3PTP4A2PTP4A1HSD17B1HSD17B2
SCHEMBL1823319 0.67 PTP4A3 (0.45) PTP4A3PTP4A2PTP4A1HSD17B1HSD17B2
SCHEMBL16546085 0.67 PTP4A3 (0.55) PTP4A3PTP4A2PTP4A1HSD17B1HSD17B2

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-20230301121-A1 PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, OPTICAL SENSOR, AND COMPOUND FUJIFILM CORPORATION (JP) 2023-09-21 US disclosed
US-20230301121-A1 PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, OPTICAL SENSOR, AND COMPOUND FUJIFILM CORPORATION (JP) 2023-09-21 US disclosed