SCHEMBL30489261

SCHEMBL30489261

Cn1c2ccccc2c2cc(C=O)ccc21.NNC(=S)S

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.50
POLB P06746 4/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 5/20 0.46
MEN1 O00255 3/20 0.46
APOBEC3A P31941 1/20 0.46
RAB9A P51151 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KDM4E B2RXH2 5/20 0.45
ALDH1A1 P00352 4/20 0.45
HPGD P15428 4/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CASP6 P55212 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43

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
Thiosemicarbazide SCHEMBL28053857 0.91 PTGER4 (0.51) PTGER4POLBMAPTKMT2AMEN1
SCHEMBL30489254 0.86 KDM4E (0.55) PTGER4POLBMAPTKMT2AMEN1
SCHEMBL718797 0.85 PTGER4 (0.64) PTGER4POLBMAPTKMT2AMEN1
SCHEMBL29570020 0.85 PTGER4 (0.64) PTGER4POLBMAPTKMT2AMEN1
Thiosemicarbazide SCHEMBL28889875 0.78 KDM4E (0.56) PTGER4POLBMAPTKMT2AMEN1
SCHEMBL2713434 0.77 CYP2A6 (0.53) PTGER4POLBMAPTKMT2AMEN1
SCHEMBL31711447 0.77 CYP2A6 (0.53) PTGER4POLBMAPTKMT2AMEN1
SCHEMBL11180624 0.76 GPR3 (0.57) PTGER4MAPTKMT2AMEN1RAB9A
SCHEMBL30489270 0.74 AHR (0.46) POLBMAPTKDM4EALDH1A1HPGD
SCHEMBL22166445 0.73 PTGER4 (0.56) PTGER4POLBMAPTKMT2AMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116478082-A Synthesis method of carbazolyl-containing Schiff base in eutectic solvent 陕西科技大学 2023-07-25 CN disclosed