SCHEMBL20066428

SCHEMBL20066428

CCCCOc1cc(C(N)=O)cc(N)c1NC/C=C/CNc1c(N)cc(C(N)=O)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.44
SMPD1 P17405 5/20 0.42
PDE4B Q07343 2/20 0.41
PDE4A P27815 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
BPTF Q12830 1/20 0.40
MAPK1 P28482 1/20 0.40
CNR2 P34972 2/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
SLC6A5 Q9Y345 1/20 0.37

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
SCHEMBL22121358 0.91 BPTF (0.40) SMN1; SMN2ALDH1A1SMPD1PDE4BPDE4A
SCHEMBL20066430 0.90 MAPT (0.40) SMN1; SMN2ALDH1A1SMPD1PDE4BPDE4A
SCHEMBL22121346 0.90 BPTF (0.41) SMN1; SMN2ALDH1A1SMPD1PDE4BPDE4A
SCHEMBL19451673 0.89 HTT (0.43) SMN1; SMN2ALDH1A1PDE4BPDE4APDE4C
SCHEMBL22121028 0.87 DRD2 (0.43) SMN1; SMN2ALDH1A1BPTFMAPK1LMNA
SCHEMBL31454620 0.86 ALDH1A1 (0.37) SMN1; SMN2ALDH1A1SMPD1PDE4BPDE4A
SCHEMBL23137476 0.84 HTT (0.40) SMN1; SMN2ALDH1A1PDE4BPDE4APDE4C
SCHEMBL22150386 0.84 HTT (0.40) SMN1; SMN2ALDH1A1PDE4BPDE4APDE4C
SCHEMBL31016393 0.84 ALDH1A1 (0.34) SMN1; SMN2ALDH1A1PDE4BPDE4APDE4C
SCHEMBL20066429 0.84 MAPT (0.43) SMN1; SMN2ALDH1A1SMPD1PDE4BPDE4A

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-20230398225-A1 PD-L1/STING CONJUGATES AND METHODS OF USE INCYTE CORPORATION 2023-12-14 US disclosed
US-20180105514-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-04-19 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-20230398225-A1 PD-L1/STING CONJUGATES AND METHODS OF USE STING1, PDCD1LG2, CD274 SMN1; SMN2 2719/4885ALDH1A1 3719/4885SMPD1 815/4885
US-20180105514-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS RB1, RBBP5, RCC2 SMN1; SMN2 2058/4885ALDH1A1 3511/4885SMPD1 4457/4885

“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.