SCHEMBL9800611

SCHEMBL9800611

NC(CC1CCCCC1)[C@@H](O)[C@@H](O)C1CC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.43
METAP2 P50579 5/20 0.39
METAP1 P53582 4/20 0.39
TP53 P04637 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GMNN O75496 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL9437467 1.00 REN (0.43) RENMETAP2METAP1TP53KDM4E
SCHEMBL7436156 1.00 REN (0.43) RENMETAP2METAP1TP53KDM4E
SCHEMBL1368930 1.00 REN (0.43) RENMETAP2METAP1TP53KDM4E
SCHEMBL9676548 0.96 REN (0.43) RENMETAP2METAP1TP53KDM4E
SCHEMBL8915949 0.94 REN (0.42) RENMETAP2METAP1TP53KDM4E
SCHEMBL25348565 0.88 METAP2 (0.41) RENMETAP2METAP1TP53KDM4E
SCHEMBL29100503 0.88 METAP2 (0.41) RENMETAP2METAP1TP53KDM4E
SCHEMBL25348570 0.88 METAP2 (0.41) RENMETAP2METAP1TP53KDM4E
Hydrochloric Acid SCHEMBL9848324 0.84 REN (0.47) RENMETAP2METAP1TP53KDM4E
SCHEMBL8908821 0.83 SHBG (0.35) REN

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-0416373-A2 Amino acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1991-03-13 EP disclosed