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SCHEMBL8586390

SCHEMBL8586390

COC(=O)OCCN1CCc2cc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2C1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MTTP P55157 14/20 0.56
▸ APOB P04114 10/20 0.56
▸ GAA P10253 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ SMO Q99835 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47

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
SCHEMBL7928573 0.93 MTTP (0.59) MTTPAPOBGAASMN1; SMN2SMO
SCHEMBL8208591 0.93 MTTP (0.56) MTTPAPOBGAASMN1; SMN2SMO
SCHEMBL8200791 0.91 MTTP (0.53) MTTPAPOBGAASMN1; SMN2SMO
SCHEMBL8199851 0.91 MTTP (0.55) MTTPAPOBGAASMN1; SMN2SMO
SCHEMBL8201182 0.90 MTTP (0.57) MTTPAPOBGAASMN1; SMN2SMO
SCHEMBL691193 0.89 MTTP (0.54) MTTPAPOBGAASMN1; SMN2SMO
SCHEMBL8213416 0.88 MTTP (0.58) MTTPAPOBGAASMN1; SMN2SMO
SCHEMBL8213404 0.88 MTTP (0.58) MTTPAPOBGAASMN1; SMN2SMO
SCHEMBL8209080 0.88 MTTP (0.56) MTTPAPOBGAASMN1; SMN2SMO
SCHEMBL8208329 0.87 MTTP (0.57) MTTPAPOBGAASMN1; SMN2SMO

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-0944602-A1 APO B-SECRETION/MTP INHIBITORY AMIDES PFIZER INC. (US) 1999-09-29 — — EP disclosed
WO-1998023593-A1 APO B-SECRETION/MTP INHIBITORY AMIDES PFIZER INC. (US) 1998-06-04 — — WO disclosed