SCHEMBL15445855

SCHEMBL15445855

C=C1CC[C@H](C(=O)OC)C1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
ALDH1A1 P00352 2/20 0.37
CHRNB2 P17787 2/20 0.37
CHRNA4 P43681 2/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA7 P36544 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PKM P14618 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
SCHEMBL4463171 1.00 BRD4 (0.42) BRD4TP53SMN1; SMN2ALDH1A1CHRNB2
SCHEMBL17756080 1.00 BRD4 (0.42) BRD4TP53SMN1; SMN2ALDH1A1CHRNB2
Bicarbonate SCHEMBL7356898 0.96 BRD4 (0.40) BRD4TP53SMN1; SMN2ALDH1A1CHRNB2
SCHEMBL31267792 0.89 SMN1; SMN2 (0.45) BRD4TP53SMN1; SMN2ALDH1A1CHRNB2
SCHEMBL3879955 0.88 TP53 (0.44) BRD4TP53SMN1; SMN2ALDH1A1CHRNB2
SCHEMBL9957179 0.83
SCHEMBL9954696 0.81 HRH3 (0.42) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL12401941 0.81 HRH3 (0.42) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL1665962 0.79 PDK1 (0.49) SMN1; SMN2ALDH1A1KDM4EMAPTMEN1
SCHEMBL17014460 0.78 BRD4 (0.47) BRD4TP53SMN1; SMN2ALDH1A1CHRNB2

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
US-20170290920-A1 ANTI-CD22 ANTIBODIES AND IMMUNOCONJUGATES MEDIMMUNE LIMITED (GB) 2017-10-12 US disclosed
US-20140030279-A1 ANTI-CD22 ANTIBODIES AND IMMUNOCONJUGATES SPIROGEN SARL (CH) 2014-01-30 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 (2 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-20170290920-A1 ANTI-CD22 ANTIBODIES AND IMMUNOCONJUGATES CD22, CD2, CD2BP2 BRD4 2527/4885TP53 2241/4885SMN1; SMN2 2478/4885
US-20140030279-A1 ANTI-CD22 ANTIBODIES AND IMMUNOCONJUGATES CD22, CD2, CD2BP2 BRD4 2527/4885TP53 2241/4885SMN1; SMN2 2478/4885

“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.