SCHEMBL26850808

SCHEMBL26850808

CCNC(=O)c1ccc(C(C)(C)C)cc1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRG P62508 5/20 0.57
ESRRB O95718 3/20 0.57
NR1H4 Q96RI1 5/20 0.52
EPHX2 P34913 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
TP53 P04637 2/20 0.46
THRB P10828 1/20 0.46
HDAC1 Q13547 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
MAPT P10636 1/20 0.44
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
NFKB1 P19838 1/20 0.43
MAPK1 P28482 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL25795350 0.89 ESRRG (0.46) ESRRGESRRBNR1H4EPHX2SMN1; SMN2
SCHEMBL7223615 0.84 ESRRB (0.56) ESRRGESRRBNR1H4EPHX2THRB
SCHEMBL9967846 0.84 ESRRG (0.56) ESRRGESRRBNR1H4EPHX2LMNA
SCHEMBL12529918 0.84 ESRRG (0.61) ESRRGESRRBNR1H4EPHX2SMN1; SMN2
SCHEMBL27398029 0.81 ESRRG (0.59) ESRRGESRRBNR1H4SMN1; SMN2TP53
SCHEMBL16418619 0.81 NR1H4 (0.53) ESRRGESRRBNR1H4EPHX2SMN1; SMN2
SCHEMBL13024606 0.81 HDAC1 (0.63) ESRRGESRRBNR1H4SMN1; SMN2TP53
SCHEMBL4156165 0.81 SMN1; SMN2 (0.64) SMN1; SMN2HDAC1HTTRAB9ANPC1
SCHEMBL4402766 0.80 HDAC1 (0.62) ESRRGESRRBNR1H4EPHX2SMN1; SMN2
SCHEMBL13894647 0.79 SMN1; SMN2 (0.46) ESRRGESRRBSMN1; SMN2THRBHTT

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-20230373933-A1 SMALL MOLECULE COMPOUND SERVING AS JAK KINASE INHIBITOR AND USE THEREOF TECHNODERMA MEDICINES INC (CN) 2023-11-23 US disclosed
US-20230373933-A1 SMALL MOLECULE COMPOUND SERVING AS JAK KINASE INHIBITOR AND USE THEREOF TECHNODERMA MEDICINES INC (CN) 2023-11-23 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-20230373933-A1 SMALL MOLECULE COMPOUND SERVING AS JAK KINASE INHIBITOR AND USE THEREOF JAK1, TYK2, JAK2 ESRRG 4163/4885ESRRB 3620/4885NR1H4 2371/4885

“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.