SCHEMBL19861424

SCHEMBL19861424

CCCCC[C@H](O)CN1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
ATM Q13315 2/20 0.52
MAPT P10636 1/20 0.52
HSD17B10 Q99714 1/20 0.43
GPR84 Q9NQS5 4/20 0.41
FFAR4 Q5NUL3 1/20 0.40
FFAR1 O14842 1/20 0.40
NFKB1 P19838 1/20 0.39
KDM4E B2RXH2 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
POLB P06746 1/20 0.38
UGCG Q16739 1/20 0.38

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
SCHEMBL15187182 0.94 KMT2A (0.58) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL15187254 0.94 KMT2A (0.58) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL3082290 0.94 KMT2A (0.58) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL15187344 0.92 KMT2A (0.61) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL5967892 0.92 KMT2A (0.61) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL15187197 0.92 KMT2A (0.61) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL31485742 0.90 ALDH1A1 (0.50) ALDH1A1L3MBTL1KMT2AMEN1GPR84
SCHEMBL29757428 0.85 ALDH1A1 (0.45) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL19710826 0.85 KMT2A (0.62) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL3082205 0.85 KMT2A (0.62) ALDH1A1L3MBTL1KMT2AMEN1ATM

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-9890198-B2 Cyclosporin derivatives and uses thereof S&T GLOBAL INC. (US) 2018-02-13 US disclosed