SCHEMBL3867320

SCHEMBL3867320

Oc1nc2c(s1)CCCC2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 3/20 0.54
FBP1 P09467 2/20 0.54
APOBEC3A P31941 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
ADRA2A P08913 4/20 0.50
ADRA2B P18089 4/20 0.50
ADRA2C P18825 4/20 0.50
TSHR P16473 1/20 0.44
RAB9A P51151 6/20 0.41
NPC1 O15118 5/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
GRM5 P41594 1/20 0.40
GRM1 Q13255 1/20 0.40
KMT2A Q03164 2/20 0.39
GAA P10253 2/20 0.39
MITF O75030 1/20 0.39
MAPT P10636 3/20 0.37
NFKB1 P19838 2/20 0.37
NFKB2 Q00653 2/20 0.37
RELA Q04206 2/20 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
SCHEMBL15653322 0.74 RAB9A (0.49) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL3090628 0.73 PDK1 (0.56) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL7325816 0.73 APOBEC3A (0.61) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL12210600 0.71 PDK1 (0.54) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL558522 0.71 APOBEC3A (0.95) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL2749715 0.71 PDK1 (0.54) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL10965367 0.71 APOBEC3A (0.59) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL17028600 0.71 APOBEC3A (0.59) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL171200 0.71 PDK1 (0.54) PDK1FBP1APOBEC3AAPOBEC3GADRA2A
SCHEMBL8003326 0.70 PDK1 (0.47) PDK1FBP1APOBEC3AAPOBEC3GADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3704094-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2026-03-11 EP disclosed
US-20240166652-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2024-05-23 US disclosed
US-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-19 US disclosed
US-7601846-B2 Compounds having activity as inhibitors of apoptosis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-10-13 US disclosed
US-20060122178-A1 Compounds having activity as inhibitors of apoptosis REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2006-06-08 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 (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-20200361941-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 PDK1 507/4885FBP1 330/4885APOBEC3A 4649/4885
US-20240166652-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 PDK1 507/4885FBP1 330/4885APOBEC3A 4649/4885
US-20060122178-A1 Compounds having activity as inhibitors of apoptosis BAD, CASP3, BAX PDK1 784/4885FBP1 695/4885APOBEC3A 2711/4885

“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.