SCHEMBL3578221

SCHEMBL3578221

CCOC(=O)C1CCC(OC[C@@H]2CCCN2OCC(=O)OC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.38
POLB P06746 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
HSD17B10 Q99714 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 2/20 0.36
RCE1 Q9Y256 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
SCHEMBL4808392 1.00 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ATSHRRAB9A
SCHEMBL2435372 0.90 SMN1; SMN2 (0.34) ALDH1A1MEN1KMT2ATSHRPOLB
SCHEMBL2432113 0.90 SMN1; SMN2 (0.34) ALDH1A1MEN1KMT2ATSHRPOLB
SCHEMBL2432163 0.90 SMN1; SMN2 (0.34) ALDH1A1MEN1KMT2ATSHRPOLB
SCHEMBL2432196 0.90 SMN1; SMN2 (0.34) ALDH1A1MEN1KMT2ATSHRPOLB
SCHEMBL2434335 0.88 SMN1; SMN2 (0.38) ALDH1A1MEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL3569177 0.88 SMN1; SMN2 (0.38) ALDH1A1MEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL71925 0.80 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ATSHRRAB9A
SCHEMBL28516288 0.80 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ATSHRPOLB
SCHEMBL2434805 0.80 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ATSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100076202-A1 METHOD FOR PRODUCING PYRROLIDINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2010-03-25 US disclosed
US-7345179-B2 Process for producing pyrrolidine derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-18 US disclosed
US-20070149607-A1 Method for producing pyrrolidine derivative DAICHI PAHARMACEUTICAL CO., LTD. (JP) 2007-06-28 US disclosed
US-20070105935-A1 Process for producing pyrrolidine derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-10 US disclosed
EP-1698621-A1 METHOD FOR PRODUCING PYRROLIDINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 EP 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 (3 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-20100076202-A1 METHOD FOR PRODUCING PYRROLIDINE DERIVATIVE ALDH18A1, PLAAT4, ACSL4 ALDH1A1 110/4885MEN1 3920/4885KMT2A 647/4885
US-20070149607-A1 Method for producing pyrrolidine derivative ALDH18A1, PLAAT4, ACSL4 ALDH1A1 110/4885MEN1 3920/4885KMT2A 647/4885
US-20070105935-A1 Process for producing pyrrolidine derivative ACSL4, ALDH18A1, LTA ALDH1A1 139/4885MEN1 2854/4885KMT2A 1387/4885

“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.