SCHEMBL7661925

SCHEMBL7661925

COc1ccc(F)cc1C[O]

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49
HPGD P15428 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 1/20 0.47
SLC6A2 P23975 10/20 0.46
SLC6A4 P31645 10/20 0.46
SLC6A3 Q01959 10/20 0.46
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
USP2 O75604 1/20 0.44
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
NFE2L2 Q16236 1/20 0.43
PKM P14618 1/20 0.42

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
SCHEMBL7673154 0.86 HDAC3 (0.46) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL30785121 0.85 KDM4E (0.53) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL321697 0.85 KDM4E (0.53) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL4625651 0.83 SLC6A4 (0.49) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL2908313 0.79 PDE4A (0.50) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL487942 0.79 HSD17B10 (0.62)
SCHEMBL1663130 0.79 SLC6A2 (0.46) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL1714408 0.79 SLC6A2 (0.46) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL6912905 0.79 SLC6A2 (0.46) ALDH1A1MEN1POLBHPGDKMT2A
SCHEMBL31119318 0.79 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6476021-B1 Compounds having cGMP-PDE inhibitory effect MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-11-05 US disclosed
EP-1048666-A1 NOVEL COMPOUNDS HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP disclosed