SCHEMBL7804301

SCHEMBL7804301

CC(C)(Oc1ccc(N2CCN(C(=O)c3cccs3)CC2)cc1)C(=O)O

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.73
MAPT P10636 6/20 0.61
ALDH1A1 P00352 5/20 0.61
LMNA P02545 3/20 0.61
GAA P10253 2/20 0.61
ALOX12 P18054 1/20 0.61
KMT2A Q03164 1/20 0.58
KDM4E B2RXH2 2/20 0.55
ITGB3 P05106 1/20 0.55
ITGA2B P08514 1/20 0.55
HTT P42858 2/20 0.53
POLB P06746 1/20 0.53
THRB P10828 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
PPARD Q03181 1/20 0.51
PPARA Q07869 1/20 0.51

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
SCHEMBL7814104 0.89 KCNA5 (0.58) KCNA5MAPTALDH1A1LMNAGAA
SCHEMBL7804354 0.82 MAPT (0.58) KCNA5MAPTALDH1A1LMNAGAA
SCHEMBL7811736 0.82 ITGB3 (0.64) MAPTALDH1A1LMNAGAAKMT2A
SCHEMBL7813784 0.81 ALDH1A1 (0.59) KCNA5MAPTALDH1A1LMNAGAA
SCHEMBL7810083 0.80 ALDH1A1 (0.69) KCNA5MAPTALDH1A1LMNAGAA
SCHEMBL7817518 0.79 ITGB3 (0.57) KCNA5MAPTALDH1A1LMNAGAA
SCHEMBL7810105 0.78 L3MBTL1 (0.68) KCNA5ALDH1A1LMNAGAAHTT
SCHEMBL7814082 0.78 ITGB3 (0.65) MAPTALDH1A1LMNAGAAKMT2A
SCHEMBL7814125 0.78 ALDH1A1 (0.72) MAPTALDH1A1LMNAGAAKMT2A
SCHEMBL27301755 0.78 MAPT (0.77) KCNA5MAPTALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0607536-B1 Arylamide derivatives SS PHARMACEUTICAL CO (JP) 2001-01-24 EP disclosed
US-5532371-A SIDE EFFECT REDUCTION SS PHARMACEUTICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5411972-A Arylamide derivatives for treating hyperlipemia SS PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US disclosed
EP-0607536-A1 Arylamide derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1994-07-27 EP disclosed