SCHEMBL7275547

SCHEMBL7275547

N[C@@H](CCC1CCCCC1)[C@@H](O)c1ccco1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.39
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.36
METAP2 P50579 3/20 0.36
BMP1 P13497 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
USP2 O75604 1/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL7293215 1.00 METAP1 (0.39) METAP1ALDH1A1KDM4EMETAP2BMP1
SCHEMBL7275541 1.00 METAP1 (0.39) METAP1ALDH1A1KDM4EMETAP2BMP1
SCHEMBL7283117 0.85 ALDH1A1 (0.39) METAP1ALDH1A1KDM4EBMP1HPGD
SCHEMBL7269414 0.85 METAP2 (0.45) METAP1KDM4EMETAP2HPGDSMN1; SMN2
SCHEMBL7269423 0.85 METAP2 (0.45) METAP1KDM4EMETAP2HPGDSMN1; SMN2
SCHEMBL7269427 0.85 METAP2 (0.45) METAP1KDM4EMETAP2HPGDSMN1; SMN2
SCHEMBL7269419 0.85 METAP2 (0.45) METAP1KDM4EMETAP2HPGDSMN1; SMN2
SCHEMBL7282960 0.80 METAP2 (0.43) METAP1KDM4EMETAP2HPGDSMN1; SMN2
SCHEMBL13724320 0.70 METAP1 (0.58) METAP1METAP2
SCHEMBL7295280 0.69 SHBG (0.42) ALDH1A1KDM4EHPGDSMN1; SMN2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5106835-A Hypotensive agents AMERICAN CYANAMID COMPANY (US) 1992-04-21 US disclosed
EP-0376040-A2 N-phosphinyl di-and tripeptides as renin inhibitors AMERICAN CYANAMID COMPANY (US) 1990-07-04 EP disclosed
EP-0376012-A2 Renin inhibitors AMERICAN CYANAMID COMPANY (US) 1990-07-04 EP disclosed