SCHEMBL6419656

SCHEMBL6419656

C=Cc1ccccc1Oc1cccc(C#N)c1C#N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 2/20 0.37
POLB P06746 1/20 0.37
HIF1A Q16665 1/20 0.33
MAOA P21397 2/20 0.33
MAOB P27338 1/20 0.33
IMPDH2 P12268 1/20 0.33
IMPDH1 P20839 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
MAP4K4 O95819 1/20 0.32
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL60842 0.83 SMN1; SMN2 (0.37) SMN1; SMN2KDM4EGAAPOLBHIF1A
SCHEMBL8626899 0.83 SMN1; SMN2 (0.50) SMN1; SMN2KDM4EGAAPOLBHIF1A
SCHEMBL29387985 0.83 SMN1; SMN2 (0.49) SMN1; SMN2KDM4EGAAPOLBHIF1A
SCHEMBL9123978 0.83 SMN1; SMN2 (0.49) SMN1; SMN2KDM4EGAAPOLBHIF1A
SCHEMBL20510894 0.78 KDM4E (0.40) SMN1; SMN2KDM4EGAAPOLBALDH1A1
SCHEMBL30360770 0.78 KDM4E (0.40) SMN1; SMN2KDM4EGAAPOLBALDH1A1
SCHEMBL297297 0.77 ALDH1A1 (0.48) SMN1; SMN2GAAALDH1A1TSHRLMNA
SCHEMBL6367706 0.77 SMN1; SMN2 (0.50) SMN1; SMN2KDM4EGAAPOLBALDH1A1
SCHEMBL9746326 0.76 SMN1; SMN2 (0.54) SMN1; SMN2KDM4EGAAPOLBHIF1A
SCHEMBL21142943 0.76 AR (0.48) SMN1; SMN2KDM4EGAAPOLBHIF1A

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-20050196454-A1 Poly(styrene-b-4-vinylphenoxyphthalonitrile) complexed with cobalt or other Group VIII metals; protective coatings VIRGINIA POLYTECHNIC INSTITUTE & STATE UNIVERSITY 2005-09-08 US claimed
US-20050196454-A1 Poly(styrene-b-4-vinylphenoxyphthalonitrile) complexed with cobalt or other Group VIII metals; protective coatings VIRGINIA POLYTECHNIC INSTITUTE & STATE UNIVERSITY 2005-09-08 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-20050196454-A1 Poly(styrene-b-4-vinylphenoxyphthalonitrile) complexed with cobalt or other Group VIII metals; protective coatings PPOX, PARN, PRNP SMN1; SMN2 741/4885KDM4E 2072/4885GAA 1886/4885

“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.