Acetone

Acetone

SCHEMBL9217023

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nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
ALDH1A1 P00352 6/20 0.43
TSHR P16473 4/20 0.43
TDP1 Q9NUW8 3/20 0.43
CA4 P22748 2/20 0.43
FFAR3 O14843 2/20 0.42
THPO P40225 1/20 0.42
LCK P06239 1/20 0.42
FYN P06241 1/20 0.42
TRPA1 O75762 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA1 P00915 2/20 0.39
ALOX15 P16050 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39

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
Acetone SCHEMBL292856 1.00 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL1831044 1.00 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL100424 1.00
Acetone SCHEMBL6859028 1.00 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL9324675 1.00 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL6859109 1.00 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL4095931 1.00 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL1244296 1.00 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL6859386 1.00 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL9723202 1.00 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468012-B1 17$g(b)-SUBSTITUTED-4-AZA-5$g(a)-ANDROSTAN-3-ONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA SPA (IT) 1995-09-20 EP disclosed
US-5342948-A Antiandrogens; ozonation, amination, reduction of androstane derivative with acyl(urea or thiourea) FARMITALIA CARLO ERBA S.R.L. (IT) 1994-08-30 US disclosed
WO-1993002096-A1 PROCESS FOR THE PREPARATION OF 17β-SUBSTITUTED-4-AZA-5α-ANDROSTAN-3-ONE DERIVATIVES FARMITALIA CARLO ERBA S.R.L. (IT) 1993-02-04 WO disclosed
EP-0523688-A1 Process for the preparation of 17beta-substituted-4-aza-5alpha-androstan-3-one derivatives PHARMACIA S.p.A. (IT) 1993-01-20 EP disclosed
US-5155107-A Inhibiting androgen action, anticarcinogenic agents, treating skin disorders, baldness FARMITALIA CARLO ERBA (IT) 1992-10-13 US disclosed
EP-0468012-A1 17-g(b)-SUBSTITUTED-4-AZA-5-g(a)-ANDROSTAN-3-ONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION. ERBA CARLO SPA (IT) 1992-01-29 EP disclosed
WO-1991012261-A1 17β-SUBSTITUTED-4-AZA-5α-ANDROSTAN-3-ONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.R.L. (IT) 1991-08-22 WO disclosed