SCHEMBL7348380

SCHEMBL7348380

CC(C)[C@@H](C[C@H](O)[C@@H](N)CC1CCCCC1)C(=O)CCCC(N)=O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 9/20 0.50
METAP2 P50579 5/20 0.39
METAP1 P53582 4/20 0.35
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
ALOX5 P09917 1/20 0.31

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
SCHEMBL7344258 0.90 REN (0.48) RENMETAP2METAP1ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL7343864 0.89 REN (0.47) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL7317650 0.84 REN (0.53) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL7317656 0.84 REN (0.53) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL7291539 0.81 REN (0.53) RENMETAP2METAP1
SCHEMBL9177605 0.81 REN (0.53) RENMETAP2METAP1
SCHEMBL10433749 0.81 REN (0.53) RENMETAP2METAP1
SCHEMBL9858518 0.78 REN (0.56) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL9575386 0.78 REN (0.56) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL9685661 0.78 REN (0.56) RENMETAP2METAP1ALDH1A1KMT2A

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
US-5120718-A Fungicides ABBOTT LABORATORIES (US) 1992-06-09 US disclosed