SCHEMBL8084112

SCHEMBL8084112

COC(=O)N1CCN(c2ccc(C(=O)CSc3ccnc4ccccc34)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
ALDH1A1 P00352 4/20 0.48
KMT2A Q03164 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
MITF O75030 1/20 0.42
RAD52 P43351 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
BRAF P15056 1/20 0.42
KDR P35968 1/20 0.42
LMNA P02545 3/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
POLB P06746 2/20 0.41
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
PRNP P04156 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL8089904 0.91 LMNA (0.51) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL8084900 0.90 SMN1; SMN2 (0.46) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL8084676 0.89 CCNC (0.46) MAPTALDH1A1SMN1; SMN2LMNAPOLB
SCHEMBL8084719 0.89 ALOX15 (0.49) MAPTALDH1A1SMN1; SMN2LMNAHPGD
SCHEMBL8084897 0.88 LMNA (0.42) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL8084656 0.88 SMN1; SMN2 (0.39) MAPTALDH1A1KMT2ASMN1; SMN2MITF
SCHEMBL8084125 0.87 TNKS (0.46) KMT2ASMN1; SMN2ADRA2AADRA2BADRA2C
SCHEMBL8088254 0.87 ADRA2A (0.51) MAPTALDH1A1SMN1; SMN2MITFRAD52
SCHEMBL8084675 0.87 SMN1; SMN2 (0.44) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL8076752 0.86 MEN1 (0.42) MAPTALDH1A1KMT2AL3MBTL1SMN1; SMN2

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-6057447-A BACTERICIDES FOR CAMPYLOBACTER ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2000-05-02 US disclosed
EP-0926139-A1 QUINOLINE SULFIDE DERIVATIVES ZENYAKU KOGYO KABUSHIKIKAISHA (JP) 1999-06-30 EP disclosed