SCHEMBL2885347

SCHEMBL2885347

O=C1N[C@@H](CO)CCc2cccnc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.35
IDH1 O75874 3/20 0.34
NSD2 O96028 2/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP1 P29466 1/20 0.34
CDC25B P30305 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
CASP7 P55210 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MTNR1A P48039 2/20 0.33

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
SCHEMBL2881994 1.00 OPRL1 (0.35) OPRL1IDH1NSD2KDM4EMEN1
SCHEMBL2883540 0.75 ALDH1A1 (0.34) OPRL1KDM4EKMT2AALDH1A1MAPT
SCHEMBL2885156 0.75 ALDH1A1 (0.34) OPRL1KDM4EKMT2AALDH1A1MAPT
SCHEMBL2883534 0.75 ALDH1A1 (0.34) OPRL1KDM4EKMT2AALDH1A1MAPT
SCHEMBL2882382 0.73 HRH1 (0.43) OPRL1IDH1KDM4EMEN1KMT2A
SCHEMBL2885507 0.72 OPRL1 (0.54) OPRL1NSD2KDM4EMEN1KMT2A
SCHEMBL2882062 0.72 OPRL1 (0.68) OPRL1HTR1ADRD2HTR2AKCNH2
SCHEMBL16585639 0.70 ABL1 (0.43)
SCHEMBL3399674 0.70 PARP10 (0.53) NSD2MEN1KMT2ATHRBCDC25B
SCHEMBL22800029 0.69 ALDH1A1 (0.37) ALDH1A1P2RX7HRH1

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-7855294-B2 Cycloalkanopyridine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-12-21 US disclosed
US-20070191419-A1 Cycloalkanopyridine derivative MSD K.K. (JP) 2007-08-16 US disclosed
EP-1726590-A1 CYCLOALKANOPYRIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-29 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 (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-20070191419-A1 Cycloalkanopyridine derivative OPRL1, OPRK1, AVPR2 OPRL1 1/4885IDH1 3596/4885NSD2 1509/4885

“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.