SCHEMBL11384828

SCHEMBL11384828

CC(C)COc1cc(=O)n(C)c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.64
SMN1; SMN2 Q16637 4/20 0.58
HPGD P15428 3/20 0.58
LMNA P02545 2/20 0.58
HTT P42858 1/20 0.58
BRD4 O60885 4/20 0.53
ALDH1A1 P00352 4/20 0.52
RAB9A P51151 1/20 0.52
KDM4E B2RXH2 1/20 0.51
NQO2 P16083 1/20 0.51
TSHR P16473 1/20 0.51
HSD17B10 Q99714 1/20 0.51

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
SCHEMBL11375444 0.83 KCNA3 (0.69) KCNA3SMN1; SMN2HPGDLMNAHTT
SCHEMBL11389662 0.81 KCNA3 (0.74) KCNA3SMN1; SMN2HPGDLMNAHTT
SCHEMBL11385254 0.79 KCNA3 (0.77) KCNA3SMN1; SMN2HPGDLMNAHTT
SCHEMBL18026627 0.79 KCNA3 (0.64) KCNA3SMN1; SMN2HPGDLMNABRD4
SCHEMBL11377494 0.78 KCNA3 (0.56) KCNA3SMN1; SMN2HPGDLMNAHTT
SCHEMBL16364135 0.78 KCNA3 (0.63) KCNA3SMN1; SMN2HPGDLMNABRD4
SCHEMBL11387758 0.78 KCNA3 (0.80) KCNA3SMN1; SMN2HPGDLMNAHTT
SCHEMBL30783436 0.78 KCNA3 (0.61) KCNA3SMN1; SMN2HPGDLMNAHTT
SCHEMBL11379787 0.78 KCNA3 (0.61) KCNA3SMN1; SMN2HPGDLMNAHTT
SCHEMBL25493370 0.77 KCNA3 (0.78) KCNA3SMN1; SMN2HPGDLMNAHTT

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
US-4273930-A INTERMEDIATES FOR THE 4-ALKOXY ANTIALLERGENS SANDOZ, INC. (US) 1981-06-16 US disclosed
US-4190659-A ANTIALLERGENS, ANTIHISTAMINES SANDOZ, INC. (US) 1980-02-26 US disclosed
US-4032528-A DEPRESSANTS SANDOZ, INC. (US) 1977-06-28 US disclosed