SCHEMBL11449356

SCHEMBL11449356

CCOC(=O)C1CC=C(N2CCCCC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
TSHR P16473 2/20 0.48
ALOX15 P16050 1/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
RAB9A P51151 1/20 0.43
POLB P06746 1/20 0.42
HPGD P15428 2/20 0.42
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL1208745 0.99 ALDH1A1 (0.52) ALDH1A1TSHRALOX15MAPK1KMT2A
SCHEMBL17338966 0.87 LGMN (0.49) ALDH1A1TSHRALOX15MAPK1POLB
SCHEMBL2253218 0.85 SMN1; SMN2 (0.41) ALDH1A1KMT2AMEN1SMN1; SMN2POLB
SCHEMBL11170137 0.78 MEN1 (0.36) ALDH1A1TSHRMAPK1KMT2AMEN1
SCHEMBL2431486 0.76 LMNA (0.51) ALDH1A1TSHRALOX15MAPK1KMT2A
SCHEMBL31601392 0.76 LMNA (0.51) ALDH1A1TSHRALOX15MAPK1KMT2A
SCHEMBL12519547 0.75 ALOX15 (0.49) ALDH1A1TSHRALOX15MAPK1KMT2A
SCHEMBL23091547 0.74 TSHR (0.48) ALDH1A1TSHRALOX15MAPK1KMT2A
SCHEMBL20562726 0.74 ALOX15 (0.57) ALDH1A1TSHRALOX15MAPK1KMT2A
SCHEMBL10939987 0.74 ALOX15 (0.45) ALDH1A1TSHRALOX15MAPK1KMT2A

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-4221800-A ANTIALLERGENS, ANTIHISTAMINES MILES LABORATORIES, INC. (US) 1980-09-09 US disclosed