SCHEMBL22628472

SCHEMBL22628472

C=C(CCNC(=O)c1ccnc(SC)n1)NC(=O)COc1ccc(C)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 0.51
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ HPGD P15428 4/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ MAPT P10636 4/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ MAPK1 P28482 1/20 0.38

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
SCHEMBL25810853 0.86 ATF4 (0.40) RXFP1MEN1KMT2AALDH1A1
SCHEMBL22628186 0.82 RXFP1 (0.54) RXFP1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL22627631 0.82 MEN1 (0.54) RXFP1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL22627747 0.82 RXFP1 (0.54) RXFP1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL22627924 0.81 RXFP1 (0.53) RXFP1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL22628316 0.81 RXFP1 (0.52) RXFP1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL20999332 0.81 HPGD (0.64) RXFP1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL22628204 0.80 RXFP1 (0.52) RXFP1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL22628214 0.80 MEN1 (0.52) RXFP1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL22627875 0.79 HPGD (0.47) RXFP1MEN1KMT2AHPGDSMN1; SMN2

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-20200345727-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-05 — — 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-20200345727-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 RXFP1 2368/4885MEN1 4714/4885KMT2A 4320/4885

“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.

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