SCHEMBL7920908

SCHEMBL7920908

Cn1ccc2cc(C(=O)O)cc(Cl)c21

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.44
TSHR P16473 2/20 0.43
MAOB P27338 1/20 0.41
TPMT P51580 2/20 0.39
SRD5A2 P31213 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
XDH P47989 1/20 0.36
CYP2C9 P11712 2/20 0.35
POLB P06746 1/20 0.35
NR4A1 P22736 1/20 0.35
PLAU P00749 1/20 0.35
ALOX15 P16050 1/20 0.34

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
SCHEMBL30829604 0.81 MYC (0.40) TTRTSHRTPMTMEN1KMT2A
SCHEMBL7926725 0.80 LMNA (0.40) TTRTPMTMEN1KMT2AXDH
SCHEMBL16597533 0.79 KMO (0.55) MAOBMEN1KMT2A
SCHEMBL5068332 0.78 CA12 (0.50) TTRTSHRTPMT
SCHEMBL30790881 0.76 XDH (0.56) MEN1KMT2AXDH
SCHEMBL18876176 0.74 KDM4E (0.38) MAOBXDH
SCHEMBL21725647 0.73 GRM2 (0.37) MAOBCYP2C9
SCHEMBL27580039 0.72 MEN1 (0.45) TSHRTPMTSRD5A2MEN1KMT2A
SCHEMBL23306334 0.72 XDH (0.38) MAOBMEN1KMT2AXDHCYP2C9
SCHEMBL17277747 0.72 TTR (0.43) TTRTSHRMAOBTPMTSRD5A2

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-6228868-B1 ANTICARCINOGENIC AND ANTITUMOR AGENTS ABBOTT LABORATORIES 2001-05-08 US disclosed
WO-2000006556-A1 SUBSTITUTED OXAZOLINES AS ANTIPROLIFERATIVE AGENTS ABBOTT LABORATORIES (US) 2000-02-10 WO disclosed