SCHEMBL11118026

SCHEMBL11118026

C=CCn1nnnc1SCI

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 5/20 0.42
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HSD17B10 Q99714 1/20 0.33
HTT P42858 1/20 0.33
CYP2C19 P33261 1/20 0.31
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL11335820 0.79 KMT2A (0.70) KMT2ALMNAALDH1A1RAB9ASMN1; SMN2
SCHEMBL10475166 0.79 LMNA (0.48) KMT2ALMNAALDH1A1RAB9ASMN1; SMN2
SCHEMBL8937769 0.78 LMNA (0.47) KMT2ALMNAALDH1A1RAB9ASMN1; SMN2
SCHEMBL1223690 0.71
SCHEMBL3244004 0.69
SCHEMBL9441451 0.69
SCHEMBL8445215 0.67
SCHEMBL3245709 0.67
SCHEMBL9367428 0.67 RAB9A (0.46) KMT2ALMNARAB9ASMN1; SMN2
SCHEMBL22245499 0.67

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
EP-0127847-A1 7-Oxo-4-thia-1-azabicyclo(3.2.0)hept-2-ene derivatives HOECHST UK LIMITED (GB) 1984-12-12 EP disclosed