SCHEMBL14384080

SCHEMBL14384080

NCCCCOc1ccc(C(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.67
▸ TSHR P16473 1/20 0.67
▸ PLA2G4B P0C869 6/20 0.65
▸ PKM P14618 1/20 0.65
▸ RARB P10826 4/20 0.61
▸ HTT P42858 3/20 0.61
▸ ALDH1A1 P00352 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ PLA2G4A P47712 1/20 0.58
▸ MAPK1 P28482 1/20 0.57
▸ POLB P06746 1/20 0.56
▸ APEX1 P27695 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ ITGB3 P05106 1/20 0.56
▸ ITGA2B P08514 1/20 0.56

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
Hydrochloric Acid SCHEMBL28033680 0.98 TP53 (0.65) TP53TSHRPLA2G4BPKMRARB
SCHEMBL12818961 0.94 PKM (0.67) TP53TSHRPLA2G4BPKMRARB
Hydrochloric Acid SCHEMBL15409937 0.93 PKM (0.65) TP53TSHRPLA2G4BPKMRARB
SCHEMBL1952122 0.90 TP53 (0.79) TP53TSHRPLA2G4BPKMRARB
SCHEMBL19729157 0.89 RARB (0.67) TP53TSHRPLA2G4BPKMRARB
SCHEMBL452572 0.89 PKM (0.69) TP53TSHRPLA2G4BPKMRARB
SCHEMBL14097198 0.88 TP53 (0.82) TP53TSHRPLA2G4BPKMRARB
SCHEMBL7911508 0.88 TP53 (0.82) TP53TSHRPLA2G4BPKMRARB
SCHEMBL2180731 0.88 TP53 (0.82) TP53TSHRPLA2G4BPKMRARB
SCHEMBL2181009 0.88 TP53 (0.82) TP53TSHRPLA2G4BPKMRARB

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
EP-2981282-B1 GROWTH HORMONE COMPOUND FORMULATION NOVO NORDISK HEALTHCARE AG (CH) 2020-11-04 — — EP disclosed
EP-2525834-B1 GROWTH HORMONES WITH PROLONGED IN-VIVO EFFICACY NOVO NORDISK HEALTHCARE AG (CH) 2019-07-17 — — EP disclosed
EP-1857447-A1 PPAR-ACTIVATING COMPOUND Kowa Company, Ltd. (JP) 2007-11-21 — — EP disclosed
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