SCHEMBL9702275

SCHEMBL9702275

O=C(O)CCC(=O)NCCCN1CCCC1=O

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.62
KMT2A Q03164 4/20 0.52
RAB9A P51151 3/20 0.52
NPC1 O15118 2/20 0.52
MEN1 O00255 2/20 0.52
TSHR P16473 2/20 0.52
LMNA P02545 1/20 0.52
ALDH1A1 P00352 1/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50

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
SCHEMBL24796621 0.87 KMT2A (0.55) MAPK1KMT2ARAB9AMEN1TSHR
SCHEMBL9702659 0.85 MAPK1 (0.61) MAPK1KMT2ARAB9ANPC1TSHR
SCHEMBL21389186 0.84 KDM4E (0.49) MAPK1KMT2ARAB9ANPC1MEN1
SCHEMBL9851181 0.84 KMT2A (0.58) MAPK1KMT2ARAB9ANPC1MEN1
SCHEMBL5656878 0.83 RAB9A (0.61) KMT2ARAB9ANPC1MEN1TSHR
SCHEMBL6359808 0.82 RAB9A (0.60) MAPK1KMT2ARAB9ANPC1MEN1
SCHEMBL4160352 0.82 MAPK1 (0.55) MAPK1KMT2ARAB9ANPC1MEN1
SCHEMBL21998655 0.82 MAPK1 (0.56) MAPK1KMT2ARAB9ANPC1MEN1
SCHEMBL21998656 0.82 MAPK1 (0.56) MAPK1KMT2ARAB9ANPC1MEN1
SCHEMBL21999368 0.82 MAPK1 (0.56) MAPK1KMT2ARAB9ANPC1MEN1

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-5118811-A Treatment and prevention of dementia and amnesia JAPAN TOBACCO INC. (JP) 1992-06-02 US disclosed
EP-0419683-A1 NEW AMINO ACID DERIVATIVES HAVING PROLYLENDOPEPTIDASE INHIBITOR ACTIVITY Japan Tobacco Inc. (JP) 1991-04-03 EP disclosed