SCHEMBL8765342

SCHEMBL8765342

CC(C)COC1C=Cc2ccccc2N1C(=O)CC(C)C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
LMNA P02545 2/20 0.55
P2RX4 Q99571 6/20 0.47
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
P2RX1 P51575 3/20 0.40
P2RX3 P56373 3/20 0.40
P2RX7 Q99572 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAPK1 P28482 1/20 0.38
PTBP1 P26599 1/20 0.35
SLC25A5 P05141 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34

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
SCHEMBL23465395 0.90 SMN1; SMN2 (0.69) SMN1; SMN2LMNAP2RX4MEN1KMT2A
SCHEMBL20358130 0.87 SMN1; SMN2 (0.57) SMN1; SMN2LMNAP2RX4MEN1KMT2A
SCHEMBL29489189 0.87 SMN1; SMN2 (0.57) SMN1; SMN2LMNAP2RX4MEN1KMT2A
SCHEMBL29427926 0.85 SMN1; SMN2 (0.69) SMN1; SMN2LMNAP2RX4MEN1KMT2A
SCHEMBL20840679 0.85 SMN1; SMN2 (0.69) SMN1; SMN2LMNAP2RX4MEN1KMT2A
SCHEMBL17633849 0.85 SMN1; SMN2 (0.69) SMN1; SMN2LMNAP2RX4MEN1KMT2A
SCHEMBL214110 0.85 SMN1; SMN2 (0.69) SMN1; SMN2LMNAP2RX4MEN1KMT2A
SCHEMBL7284649 0.84 SMN1; SMN2 (0.79) SMN1; SMN2LMNAP2RX4MEN1KMT2A
SCHEMBL4612051 0.83 SMN1; SMN2 (0.56) SMN1; SMN2LMNAP2RX4MEN1KMT2A
SCHEMBL13268519 0.79 LMNA (0.64) SMN1; SMN2LMNAP2RX4MEN1KMT2A

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
EP-0774976-A1 CONJUGATES OF VITAMIN B12 AND PROTEINS AMGEN INC. (US) 1997-05-28 EP disclosed
US-5574018-A ENHANCED ABSORPTION VIA ORAL ADMINISTRATION AMGEN INC. (US) 1996-11-12 US disclosed
WO-1996004016-A1 CONJUGATES OF VITAMIN B12 AND PROTEINS AMGEN INC. (US) 1996-02-15 WO disclosed