SCHEMBL7380201

SCHEMBL7380201

Cc1ccc(S(=O)(=O)N2CCC(C(=O)O)C(=O)c3cc(OC(F)(F)F)ccc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 3/20 0.45
▸ EPHX1 P07099 1/20 0.45
▸ HTR6 P50406 1/20 0.41
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 4/20 0.38
▸ FFAR4 Q5NUL3 2/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CYP11B1 P15538 1/20 0.38
▸ LIPE Q05469 1/20 0.38
▸ HSD11B1 P28845 1/20 0.37
▸ AR P10275 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NR1I2 O75469 1/20 0.37
▸ RORC P51449 1/20 0.37
▸ NR1H2 P55055 1/20 0.37

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
SCHEMBL7664737 0.89 ALDH1A1 (0.45) EPHX2EPHX1HTR6GAAALDH1A1
SCHEMBL7383036 0.78 CYP11B1 (0.49) MAPTLMNACYP11B1MEN1KMT2A
SCHEMBL16723452 0.76 MAPT (0.43) GAAMAPTCYP2C9KDM4EALDH1A1
SCHEMBL7385171 0.75 EPHX2 (0.46) EPHX2EPHX1HTR6GAAMAPT
SCHEMBL7497164 0.75 EPHX2 (0.46) EPHX2EPHX1HTR6GAAMAPT
SCHEMBL7497168 0.75 EPHX2 (0.46) EPHX2EPHX1HTR6GAAMAPT
SCHEMBL25429745 0.74 ALDH1A1 (0.48) GAAMAPTALDH1A1LMNAMEN1
SCHEMBL1292014 0.72 ALDH1A1 (0.48) GAAMAPTALDH1A1LMNAMEN1
SCHEMBL17158242 0.71 KCNN4 (0.50) GAAMAPTCYP2C9KDM4EALDH1A1
SCHEMBL22578028 0.70 ALDH1A1 (0.52) GAAMAPTKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1000067-B1 THIAZOLOBENZOHETEROCYCLES, PREPARATION AND MEDICINES CONTAINING SAME AVENTIS PHARMA SA (FR) 2002-10-23 — — EP disclosed
EP-1000067-A1 THIAZOLOBENZOHETEROCYCLES, PREPARATION AND MEDICINES CONTAINING SAME Aventis Pharma S.A. (FR) 2000-05-17 — — EP disclosed
WO-1999005147-A1 THIAZOLOBENZOHETEROCYCLES, PREPARATION AND MEDICINES CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1999-02-04 — — WO disclosed
Send feedback