SCHEMBL4924876

SCHEMBL4924876

CCC(CC)C(=O)N(Cc1ccc(C(=O)NCc2ccc(OC)c(OC)c2)cc1)C1CCN(Cc2ccc(C#N)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
MMP2 P08253 1/20 0.45
MMP13 P45452 1/20 0.45
DRD2 P14416 1/20 0.45
DRD1 P21728 1/20 0.45
DRD4 P21917 1/20 0.45
DRD5 P21918 1/20 0.45
DRD3 P35462 1/20 0.45
CHRM3 P20309 1/20 0.44
ALDH1A1 P00352 2/20 0.44
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
TP53 P04637 1/20 0.42
CHRM4 P08173 1/20 0.42
CTSD P07339 1/20 0.42

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
SCHEMBL4917345 0.93 SMN1; SMN2 (0.47) SMN1; SMN2LMNAMMP2MMP13DRD2
SCHEMBL4924928 0.91 OPRM1 (0.50) SMN1; SMN2LMNAMMP2MMP13DRD2
SCHEMBL4916346 0.91 SMN1; SMN2 (0.49) SMN1; SMN2LMNAALDH1A1POLBGAA
SCHEMBL4913049 0.91 TSHR (0.51) SMN1; SMN2LMNACHRM3ALDH1A1POLB
SCHEMBL4923909 0.91 LMNA (0.49) SMN1; SMN2LMNAALDH1A1POLBGAA
SCHEMBL4922742 0.90 TSHR (0.52) SMN1; SMN2CHRM3CHRM4
SCHEMBL4924921 0.90 SMN1; SMN2 (0.48) SMN1; SMN2LMNAALDH1A1POLBGAA
SCHEMBL4921293 0.90 ALDH1A1 (0.55) SMN1; SMN2LMNAALDH1A1POLBGAA
SCHEMBL4921438 0.89 SMN1; SMN2 (0.46) SMN1; SMN2LMNAMMP2MMP13DRD2
SCHEMBL4916484 0.89 SMN1; SMN2 (0.47) SMN1; SMN2LMNAMMP2MMP13DRD2

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-20080081824-A1 Substituted piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY 2008-04-03 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-20080081824-A1 Substituted piperidines as modulators of chemokine receptor activity CCR1, CCR3, CCR2 SMN1; SMN2 3688/4885LMNA 2533/4885MMP2 794/4885

“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.