SCHEMBL9380409

SCHEMBL9380409

Cc1cccc([C@@H]2O[C@H]2/C=C/C=O)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTR2C P28335 3/20 0.36
PBRM1 Q86U86 4/20 0.35
CYP19A1 P11511 1/20 0.35
ACHE P22303 1/20 0.34
SLC5A2 P31639 3/20 0.34
HDAC4 P56524 1/20 0.34
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.33
HTR2B P41595 1/20 0.33
SLC6A3 Q01959 1/20 0.33
NPC1 O15118 1/20 0.33
HPN P05981 1/20 0.33
HSD11B1 P28845 1/20 0.33

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
SCHEMBL9378128 1.00 MEN1 (0.37) MEN1KMT2AHTR2CPBRM1CYP19A1
SCHEMBL9802086 0.83 KMT2A (0.41) MEN1KMT2AHTR2CPBRM1CYP19A1
SCHEMBL9378737 0.83 KMT2A (0.41) MEN1KMT2AHTR2CPBRM1CYP19A1
SCHEMBL9380385 0.80 MEN1 (0.41) MEN1KMT2AHTR2CCYP19A1HTR2A
SCHEMBL9377930 0.79 LMNA (0.39) MEN1KMT2A
SCHEMBL10372159 0.79 LMNA (0.39) MEN1KMT2A
SCHEMBL9382305 0.77 HTR2C (0.40) HTR2CPBRM1HTR2AHTR2B
SCHEMBL9377796 0.76 ERN1 (0.40) NPC1
SCHEMBL5852622 0.69 ACHE (0.48) MEN1KMT2AHTR2CCYP19A1ACHE
SCHEMBL30717247 0.69 ACHE (0.48) MEN1KMT2AHTR2CCYP19A1ACHE

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-0335315-B1 New alkanephenones CIBA GEIGY AG (CH) 1994-06-22 EP disclosed
US-5149717-A Alkanophenones useful for treating allergies CIBA-GEIGY CORPORATION (US) 1992-09-22 US disclosed
EP-0335315-A1 New alkanephenones CIBA-GEIGY AG (CH) 1989-10-04 EP disclosed