SCHEMBL20464260

SCHEMBL20464260

CC(O)C(=O)Nc1cnc(C(C)(C)C)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ RAB9A P51151 5/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ TP53 P04637 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ FFAR2 O15552 2/20 0.35
▸ MKNK1 Q9BUB5 2/20 0.33
▸ DEGS1 O15121 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ TSHR P16473 1/20 0.33
▸ XIAP P98170 1/20 0.32
▸ BIRC2 Q13490 1/20 0.32
▸ HCAR3 P49019 1/20 0.32

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
SCHEMBL20462622 0.89 ALDH1A1 (0.42) MAPK1L3MBTL1RAB9ANPC1MAPT
SCHEMBL18214838 0.78 NOTUM (0.44) MAPK1L3MBTL1RAB9ANPC1MAPT
SCHEMBL19699546 0.74 SMN1; SMN2 (0.47) RAB9ANPC1MAPTTP53SMN1; SMN2
SCHEMBL839860 0.73 RAB9A (0.66) L3MBTL1RAB9ANPC1MAPTTP53
SCHEMBL12690881 0.72 ALDH1A1 (0.58) SMN1; SMN2MKNK1ALDH1A1HCAR3
SCHEMBL12690425 0.72 HCAR3 (0.40) L3MBTL1RAB9ANPC1MAPTGAA
SCHEMBL12690256 0.69 HCAR3 (0.34) HCAR3
SCHEMBL29806129 0.69 L3MBTL1 (0.67) MAPK1L3MBTL1RAB9ANPC1MAPT
SCHEMBL29806209 0.69 L3MBTL1 (0.67) MAPK1L3MBTL1RAB9ANPC1MAPT
SCHEMBL3511305 0.68 ABCC9 (0.38) RAB9ANPC1MAPTTP53SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10487068-B2 Pyridazine derivatives as RORc modulators GENENTECH, INC. (US) 2019-11-26 — — US disclosed
US-20180222882-A1 PYRIDAZINE DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2018-08-09 — — 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-10487068-B2 Pyridazine derivatives as RORc modulators RORC, RORB, RORA MAPK1 1203/4885L3MBTL1 4333/4885RAB9A 2135/4885
US-20180222882-A1 PYRIDAZINE DERIVATIVES AS RORc MODULATORS RORC, RORB, RORA MAPK1 1203/4885L3MBTL1 4333/4885RAB9A 2135/4885

“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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