SCHEMBL24714540

SCHEMBL24714540

CC(C)(C)c1nc(=O)c2cn[nH]c2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
XDH P47989 9/20 0.44
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
JAK3 P52333 1/20 0.35
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL4627473 0.77 XDH (0.51) XDHALDH1A1SMN1; SMN2LMNAJAK2
SCHEMBL8241597 0.76 XDH (0.44) XDHALDH1A1SMN1; SMN2LMNAJAK2
SCHEMBL3700367 0.74 XDH (0.49) XDHALDH1A1SMN1; SMN2LMNAJAK2
Oxypurinol SCHEMBL8257647 0.73 XDH (0.48) XDHALDH1A1SMN1; SMN2LMNAJAK2
SCHEMBL18701487 0.72 ALDH1A1 (0.56) XDHALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL16212717 0.72 TYMP (0.42) L3MBTL1ALDH1A1SMN1; SMN2JAK2JAK1
SCHEMBL24351056 0.72 XDH (0.44) XDHALDH1A1LMNAJAK2JAK1
SCHEMBL10779485 0.67 ALDH1A1 (0.44) L3MBTL1ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL17731840 0.67 L3MBTL1 (0.38) L3MBTL1
SCHEMBL1847814 0.64 CYP1A2 (0.41) XDHLMNA

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-20220235032-A1 BISHETEROCYCLIC CARBONYL SUBSTITUTED DIHYDROPYRAZOLE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2022-07-28 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-20220235032-A1 BISHETEROCYCLIC CARBONYL SUBSTITUTED DIHYDROPYRAZOLE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF RIPK1, RIPK4, RIPK3 XDH 2248/4885L3MBTL1 4089/4885ALDH1A1 3224/4885

“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.