SCHEMBL7450573

SCHEMBL7450573

CCCc1n[nH]c(C(=O)NC)c1NC(=O)c1cc(S(=O)(=O)Cl)ccc1OCC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.40
RXFP1 Q9HBX9 3/20 0.36
MRGPRX1 Q96LB2 3/20 0.36
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35
KMT2A Q03164 1/20 0.35
PARP1 P09874 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
HTT P42858 1/20 0.35
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL7451494 0.82 APEX1 (0.47) KMT2ALMNAMAPK1
SCHEMBL7450532 0.81 PDE5A (0.48) KMT2A
SCHEMBL7922235 0.80 CREBBP (0.38) RXFP1KMT2APARP1HPGDALOX15
SCHEMBL7450580 0.79 LMNA (0.41) HSD17B10PTPN2PTPN1KMT2ALMNA
SCHEMBL8125815 0.76 TERT (0.62) HSD17B10RXFP1KMT2ALMNAMAPK1
SCHEMBL7362179 0.75 KMT2A (0.45) KMT2AALOX15LMNAMAPK1RAB9A
SCHEMBL963 0.73 MAPT (0.48) HSD17B10RXFP1KMT2APARP1ALOX15
SCHEMBL3133104 0.73 CA2 (0.35) HSD17B10RXFP1KMT2ALMNAMAPK1
SCHEMBL6806762 0.70 RXFP1 (0.38) HSD17B10RXFP1MRGPRX1LMNAMAPK1
SCHEMBL1705329 0.70 TERT (0.61) RXFP1LMNARAB9AHTTMAPT

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
WO-2001087888-A1 PYRAZOLOPYRIMIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE SK CHEMICALS CO., LTD. (KR) 2001-11-22 WO disclosed