SCHEMBL8472242

SCHEMBL8472242

O=C(NCCCN1CCCC1=O)c1[nH]c2ccccc2c1C(c1ccccc1)c1ccc(OCCN2CCCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
LMNA P02545 3/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
RCE1 Q9Y256 1/20 0.43
POLB P06746 1/20 0.42
APOBEC3A P31941 1/20 0.42
CASP6 P55212 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LTA4H P09960 1/20 0.42
KDM4E B2RXH2 3/20 0.42
TP53 P04637 1/20 0.42
RAB9A P51151 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
HRH3 Q9Y5N1 2/20 0.42
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL8471948 0.90 SMN1; SMN2 (0.47) SMN1; SMN2LMNAKMT2AMEN1RCE1
SCHEMBL8472240 0.88 SMN1; SMN2 (0.42) SMN1; SMN2LMNAKMT2AMEN1RCE1
SCHEMBL8472673 0.86 HRH3 (0.48) SMN1; SMN2LMNAKMT2AMEN1POLB
SCHEMBL8475772 0.84 SMN1; SMN2 (0.46) SMN1; SMN2LMNAKMT2ARCE1POLB
SCHEMBL8472659 0.83 MEN1 (0.59) KMT2AMEN1POLBAPOBEC3ACASP6
SCHEMBL8472467 0.82 LTA4H (0.51) KMT2AMEN1POLBAPOBEC3ACASP6
SCHEMBL8472281 0.80 HRH3 (0.47) KMT2AMEN1POLBAPOBEC3ACASP6
SCHEMBL8476781 0.77 EPHX2 (0.48) KMT2AMEN1POLBAPOBEC3ACASP6
SCHEMBL8472571 0.77 DRD2 (0.52) KMT2AMEN1POLBAPOBEC3ACASP6
SCHEMBL8472345 0.77 SMN1; SMN2 (0.45) SMN1; SMN2LMNAKMT2AMEN1RCE1

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-5891902-A OSTEOPOROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-04-06 US disclosed
EP-0782989-A1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-07-09 EP disclosed