SCHEMBL3789075

SCHEMBL3789075

O=C(OCC1c2ccccc2-c2ccccc21)N1CC[C@H](O)C1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
FABP5 Q01469 3/20 0.43
FABP7 O15540 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PDK2 Q15119 1/20 0.42
EPHX2 P34913 1/20 0.41
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
OPRD1 P41143 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
F10 P00742 1/20 0.39
TSHR P16473 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL3785639 1.00 KMT2A (0.44) KMT2AFABP5FABP7L3MBTL1PDK2
SCHEMBL30951907 1.00 KMT2A (0.44) KMT2AFABP5FABP7L3MBTL1PDK2
SCHEMBL30564450 1.00 KMT2A (0.44) KMT2AFABP5FABP7L3MBTL1PDK2
SCHEMBL693889 0.92 L3MBTL1 (0.48) KMT2AFABP5FABP7L3MBTL1EPHX2
SCHEMBL6206152 0.91 PRMT5 (0.46) KMT2AFABP5FABP7L3MBTL1EPHX2
SCHEMBL30449879 0.86 KMT2A (0.44) KMT2AFABP5FABP7L3MBTL1EPHX2
SCHEMBL3783603 0.86 KMT2A (0.44) KMT2AFABP5FABP7L3MBTL1EPHX2
SCHEMBL3780174 0.86 KMT2A (0.44) KMT2AFABP5FABP7L3MBTL1EPHX2
SCHEMBL29911437 0.86 KMT2A (0.44) KMT2AFABP5FABP7L3MBTL1EPHX2
SCHEMBL800040 0.84 SMN1; SMN2 (0.53) KMT2AFABP5FABP7L3MBTL1PDK2

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-20100174096-A1 Methods for Production of Optically Active Fluoropyrrolidine Derivatives IM&T RESEARCH, INC. (US) 2010-07-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100174096-A1 Methods for Production of Optically Active Fluoropyrrolidine Derivatives QDPR, FDPS, DPYD KMT2A 4142/4885FABP5 1284/4885FABP7 1101/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.