SCHEMBL5222475

SCHEMBL5222475

CNCC(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.46
KMT2A Q03164 1/20 0.39
PAX8 Q06710 1/20 0.39
TACR1 P25103 9/20 0.39
MAPT P10636 1/20 0.37
ALDH1A1 P00352 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
TACR3 P29371 2/20 0.35
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
GPBAR1 Q8TDU6 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
SCHEMBL5492653 0.79 ADRA2A (0.47) TAAR1KMT2AMAPTALDH1A1SLC6A2
SCHEMBL9886102 0.78 TACR1 (0.41) KMT2ATACR1ALDH1A1IDO1TDO2
SCHEMBL22222396 0.78 TACR1 (0.41) KMT2ATACR1ALDH1A1IDO1TDO2
SCHEMBL23717170 0.78 TACR1 (0.41) KMT2ATACR1ALDH1A1IDO1TDO2
SCHEMBL4478411 0.78 TACR1 (0.44) TACR1MAPTALDH1A1TACR3
SCHEMBL2484826 0.78 GRIA4 (0.56) TACR1MAPTALDH1A1CA1CA2
SCHEMBL4478694 0.78 TACR1 (0.44) TACR1MAPTALDH1A1TACR3
SCHEMBL2802418 0.76 TACR1 (0.43) TACR1MAPTALDH1A1
SCHEMBL2181410 0.76 TACR1 (0.43) TACR1MAPTALDH1A1
SCHEMBL5412263 0.76 TACR1 (0.43) TACR1MAPTALDH1A1TACR3

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
EP-1765780-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2007-03-28 EP disclosed
WO-2006004195-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2006-01-12 WO disclosed