SCHEMBL11759682

SCHEMBL11759682

O=C(c1ccccc1Cl)C1CN2CCC1CC2

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.54
ALDH1A1 P00352 2/20 0.51
KDM2B Q8NHM5 1/20 0.48
ATM Q13315 1/20 0.47
RAB9A P51151 2/20 0.46
MGLL Q99685 1/20 0.44
BDKRB1 P46663 1/20 0.43
HSD11B1 P28845 1/20 0.42
CHRNA7 P36544 1/20 0.42
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL14808705 0.82 ALDH1A1 (0.58) GAAALDH1A1
SCHEMBL14808496 0.81 GAA (0.53) GAAALDH1A1KDM2BATMMAPT
SCHEMBL27894145 0.78 GAA (0.46) GAAALDH1A1KDM2BATMRAB9A
SCHEMBL14808331 0.78 ALDH1A1 (0.69) GAAALDH1A1CHRNA7
SCHEMBL14808505 0.77 ALDH1A1 (0.56) GAAALDH1A1ATM
SCHEMBL14807964 0.75 ALDH1A1 (0.70) GAAALDH1A1KDM2BRAB9AMGLL
SCHEMBL14808557 0.74 ALDH1A1 (0.53) GAAALDH1A1RAB9ACHRNA7MAPT
SCHEMBL14821867 0.74 ALDH1A1 (0.57) GAAALDH1A1CHRNA7
SCHEMBL14808313 0.74 TSHR (0.61) GAAALDH1A1KDM2BMGLLHSD11B1
SCHEMBL14808621 0.73 ALDH1A1 (0.67) GAAALDH1A1KDM2B

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-4038402-A METHOD OF EFFECTING ANTIHISTAMINIC, ANTISEROTONIN AND ANTIALLERGIC ACTIONS KAMINKA MIKHAIL EMMANUILOVICH 1977-07-26 US disclosed