SCHEMBL26351997

SCHEMBL26351997

CC(C)(C)c1ccc2ncc(C(N)=O)cc2c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 1/20 0.50
▸ LRRK2 Q5S007 1/20 0.46
▸ TRPV1 Q8NER1 1/20 0.45
▸ PSMD14 O00487 1/20 0.41
▸ STAMBP O95630 1/20 0.41
▸ COPS5 Q92905 1/20 0.41
▸ SCN10A Q9Y5Y9 4/20 0.41
▸ ALPL P05186 2/20 0.41
▸ MGAM O43451 1/20 0.41
▸ IKBKB O14920 1/20 0.40
▸ CYP17A1 P05093 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CHEK2 O96017 1/20 0.39
▸ EPHX2 P34913 1/20 0.38
▸ NR1H4 Q96RI1 1/20 0.38
▸ DHODH Q02127 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
SCHEMBL13552144 0.88 ALPL (0.46) HPGDSLRRK2TRPV1ALPLCYP17A1
SCHEMBL1644022 0.86 MGAM (0.57) TRPV1PSMD14ALPLMGAMEPHX2
SCHEMBL7449066 0.85 KMT2A (0.47) HPGDSPSMD14STAMBPCOPS5MGAM
SCHEMBL5405254 0.82 HPGDS (0.55) HPGDSPSMD14STAMBPCOPS5ALPL
SCHEMBL15125086 0.80 HPGDS (0.54) HPGDSPSMD14STAMBPCOPS5ALPL
SCHEMBL1644595 0.79 MAOB (0.54) TRPV1
SCHEMBL4548632 0.78 SCN10A (0.42) LRRK2TRPV1SCN10A
SCHEMBL2627053 0.77 LCK (0.56) LRRK2CYP17A1CYP3A4EPHX2NR1H4
SCHEMBL15775057 0.76 ALPL (0.50) HPGDSPSMD14STAMBPCOPS5ALPL
SCHEMBL3868878 0.76 HPGDS (0.50) HPGDSPSMD14STAMBPCOPS5ALPL

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-20230303562-A1 PYRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-09-28 — — 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-20230303562-A1 PYRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP51A1, CYP4F11, WEE1 HPGDS 1294/4885LRRK2 3462/4885TRPV1 2224/4885

“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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