SCHEMBL2159105

SCHEMBL2159105

CNC(=O)[C@H]1CCC[C@@H](C(=O)OC)C1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
CHRNB2 P17787 4/20 0.40
CHRNA4 P43681 4/20 0.40
CHRNA7 P36544 2/20 0.40
CHRNB4 P30926 2/20 0.40
CHRNA3 P32297 2/20 0.40
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM3 P20309 1/20 0.39
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
BCHE P06276 1/20 0.36
HSD11B1 P28845 1/20 0.35
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
BRD4 O60885 1/20 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
SCHEMBL2159101 1.00 SMN1; SMN2 (0.42) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4
SCHEMBL5909104 0.88 CHRNB2 (0.48) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4
SCHEMBL62434 0.88 SMN1; SMN2 (0.50) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4
SCHEMBL86929 0.88 SMN1; SMN2 (0.50) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4
SCHEMBL26650248 0.84 CHRNB2 (0.50) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4
SCHEMBL26650243 0.84 CHRNB2 (0.50) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4
SCHEMBL15087605 0.82 BTK (0.45) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4
SCHEMBL10137131 0.81 SMN1; SMN2 (0.58) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4
SCHEMBL595590 0.80 BTK (0.49) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4
SCHEMBL17099599 0.80 BTK (0.49) SMN1; SMN2CHRNB2CHRNA4CHRNA7CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2472319-B1 Titanium black dispersion composition for a solid state imaging element, black radiation-sensitive composition containing the same, use of the composition for forming a black cured film, method of producing a black cured film FUJIFILM CORP (JP) 2017-04-19 EP disclosed
EP-2472319-A2 Titanium black dispersion composition, black radiation-sensitive composition containing the same, black cured film, solid state imaging element and method for producing a black cured film Fujifilm Corporation (JP) 2012-07-04 EP disclosed
US-20110245226-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2011-10-06 US disclosed
US-7985861-B2 Piperidinyl derivatives as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2011-07-26 US disclosed
US-20090298833-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2009-12-03 US disclosed
US-7601844-B2 Piperidinyl derivatives as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2009-10-13 US disclosed
US-20070208056-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2007-09-06 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 (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-20090298833-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY CCR1, CCR2, CCR3 SMN1; SMN2 4000/4885CHRNB2 2173/4885CHRNA4 1832/4885
US-20070208056-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY CCR1, CCR2, CCR3 SMN1; SMN2 4000/4885CHRNB2 2173/4885CHRNA4 1832/4885
US-20110245226-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY CCR1, CCR2, CCR3 SMN1; SMN2 4000/4885CHRNB2 2173/4885CHRNA4 1832/4885

“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.