SCHEMBL8470841

SCHEMBL8470841

CCCCS(=O)(=O)N1CCc2cc(OC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2C1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 2/20 0.40
▸ MTTP P55157 6/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ S1PR1 P21453 2/20 0.39
▸ GAA P10253 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ DRD2 P14416 1/20 0.37
▸ DRD3 P35462 1/20 0.37
▸ APOB P04114 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ RORC P51449 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ UBE2M P61081 1/20 0.36
▸ DCUN1D1 Q96GG9 1/20 0.36

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
SCHEMBL8470288 0.95 MAPT (0.42) EPHX2MTTPALDH1A1HPGDKMT2A
SCHEMBL8473518 0.81 MTTP (0.40) MTTPALDH1A1KDM4ETSHR
SCHEMBL8471802 0.80 ESR1 (0.49) MTTPALDH1A1HPGDKMT2AHDAC6
SCHEMBL8470752 0.80 ESR1 (0.43) MTTPALDH1A1KDM4ETSHR
SCHEMBL8473043 0.80 HDAC6 (0.42) ALDH1A1HPGDKMT2AHDAC6GAA
SCHEMBL8472683 0.79 MTTP (0.42) MTTPALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL8582518 0.79 ESR1 (0.44) MTTPALDH1A1KMT2AGAASMN1; SMN2
SCHEMBL8471797 0.78 ESR1 (0.43) MTTPALDH1A1KMT2AKDM4E
SCHEMBL8473577 0.78 HPGD (0.42) MTTPALDH1A1HPGDS1PR1GAA
SCHEMBL8474115 0.78 KDM4E (0.51) MTTPALDH1A1KDM4ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5919795-A ATHEROSCLEROSIS THERAPY PFIZER INC. (US) 1999-07-06 — — US disclosed
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