Acedoben

Acedoben

SCHEMBL9724003

CC(=O)Nc1ccc(C(=O)O)cc1.O=C(O)c1ccc(O)cc1

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.77
ALDH1A1 P00352 4/20 0.77
KMT2A Q03164 4/20 0.77
MEN1 O00255 3/20 0.77
CA12 O43570 2/20 0.77
CA1 P00915 2/20 0.77
CA2 P00918 2/20 0.77
CA3 P07451 2/20 0.77
CA4 P22748 2/20 0.77
CA7 P43166 2/20 0.77
CA9 Q16790 2/20 0.77
CA14 Q9ULX7 2/20 0.77
BRD4 O60885 1/20 0.77
NR1I2 O75469 1/20 0.77
MB P02144 1/20 0.77
CYP1A1 P04798 1/20 0.77
CYP3A4 P08684 1/20 0.77
RARG P13631 1/20 0.77
TSHR P16473 1/20 0.77
ALOX5AP P20292 1/20 0.77

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
Acetaminophen SCHEMBL27093528 0.93 MAPT (0.71) MAPTALDH1A1KMT2AMEN1CA12
Acedoben SCHEMBL24320 0.92 ALDH1A1 (0.68) MAPTALDH1A1KMT2AMEN1CA12
Acedoben SCHEMBL11793874 0.90 ALDH1A1 (0.66) MAPTALDH1A1KMT2AMEN1CA12
Acedoben SCHEMBL3464430 0.90 ALDH1A1 (0.66) MAPTALDH1A1KMT2AMEN1CA12
Acedoben SCHEMBL1458995 0.90 ALDH1A1 (0.66) MAPTALDH1A1KMT2AMEN1CA12
Acedoben SCHEMBL11274912 0.90 ALDH1A1 (0.66) MAPTALDH1A1KMT2AMEN1CA12
Acetaminophen SCHEMBL28267915 0.90 KMT2A (0.95) MAPTALDH1A1KMT2AMEN1CA12
Acedoben SCHEMBL11257704 0.88 ALDH1A1 (0.63) MAPTALDH1A1KMT2AMEN1CA12
Acetaminophen SCHEMBL28994743 0.88 KMT2A (0.91) MAPTALDH1A1KMT2AMEN1CA12
Acetaminophen SCHEMBL9786571 0.88 KMT2A (0.91) MAPTALDH1A1KMT2AMEN1CA12

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-RE32268-E VIRICIDES STRATEGIC MEDICAL RESEARCH CORP. (US) 1986-10-21 US claimed
US-4016261-A VIRICIDE MONOSACCHARIDES STRATEGIC MEDICAL RESEARCH CORPORATION (US) 1977-04-05 US claimed
US-5157024-A Method of enhancing the activity of phagocytes including macrophages, modulating the cellular or humoral immune response, and reducing the adverse effects of stress in warm blooded animals STRATEGIC MEDICAL RESEARCH CORPORATION (US) 1992-10-20 US disclosed