SCHEMBL9011263

SCHEMBL9011263

O=C(O)Cc1ccccc1C1=CCN(C(=O)c2cccc3ccccc23)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGDR Q13258 4/20 0.46
PTGDR2 Q9Y5Y4 4/20 0.46
PTGER2 P43116 3/20 0.46
CYP2C9 P11712 1/20 0.46
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
AVPR1A P37288 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL9011160 0.83 ALDH1A1 (0.52) PTGDRPTGDR2PTGER2CYP2C9ALDH1A1
SCHEMBL7811466 0.82 ALDH1A1 (0.49) PTGDRPTGDR2PTGER2CYP2C9ALDH1A1
SCHEMBL9011037 0.81 ALDH1A1 (0.52) PTGDRPTGDR2PTGER2CYP2C9ALDH1A1
SCHEMBL9011192 0.77 MEN1 (0.51) PTGDRPTGDR2PTGER2CYP2C9ALDH1A1
SCHEMBL7804666 0.77 ALDH1A1 (0.54) PTGDRPTGDR2PTGER2CYP2C9ALDH1A1
SCHEMBL7813977 0.75 S1PR1 (0.52) PTGDRPTGDR2PTGER2CYP2C9ALDH1A1
SCHEMBL6711077 0.75 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AKDM4ELMNA
SCHEMBL7811365 0.74 ALDH1A1 (0.49) PTGDRPTGDR2PTGER2CYP2C9ALDH1A1
SCHEMBL9011156 0.74 USP2 (0.66) ALDH1A1MEN1KMT2AKDM4ETDP1
SCHEMBL9010984 0.72 PTGDR (0.47) PTGDRPTGDR2PTGER2CYP2C9ALDH1A1

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
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