SCHEMBL6858151

SCHEMBL6858151

C[C@H]1CNn2nc(C(=O)O)cc2C1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.37
ESR1 P03372 1/20 0.36
HCAR2 Q8TDS4 4/20 0.35
PLAT P00750 1/20 0.34
HCAR3 P49019 1/20 0.33
DAO P14920 1/20 0.32
ALDH1A1 P00352 3/20 0.31
APOBEC3A P31941 1/20 0.30
APOBEC3G Q9HC16 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL6383954 0.72 USP2 (0.43) POLBESR1HCAR2ALDH1A1HTT
SCHEMBL31389644 0.66 POLB (0.37) POLBESR1HCAR2PLATALDH1A1
SCHEMBL25433166 0.61 GRM5 (0.42) POLBESR1HCAR2ALDH1A1
SCHEMBL25433533 0.61 GRM5 (0.42) POLBESR1HCAR2ALDH1A1
SCHEMBL2152111 0.59 HCAR2 (0.41) POLBHCAR2HCAR3DAOALDH1A1
SCHEMBL31389630 0.58 RIPK1 (0.39) POLBESR1HCAR2PLATDAO
SCHEMBL3310783 0.58 HDAC6 (0.41) POLBALDH1A1APOBEC3AAPOBEC3G
SCHEMBL23000276 0.58 POLB (0.33) POLBHCAR2DAOALDH1A1APOBEC3A
SCHEMBL12282789 0.58 PDCD1 (0.43) POLBHCAR2PLATAPOBEC3AAPOBEC3G
SCHEMBL1815818 0.58 KMO (0.42) POLBALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6831074-B2 Inhibitors of cyclic guanosine 3',5'-monophosphate phosphodiesterases (cGMP PDES); for use in therapy of sexual disorders PFIZER INC 2004-12-14 US disclosed