SCHEMBL24113246

SCHEMBL24113246

COC(=O)/C(=C/c1ccc(F)cc1OC)N=[N+]=[N-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.38
▸ CTSB P07858 1/20 0.38
▸ MEN1 O00255 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ AR P10275 1/20 0.34
▸ APP P05067 1/20 0.34
▸ CYP1A2 P05177 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ ADORA2B P29275 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL30310695 1.00 CTSL (0.38) CTSLCTSBMEN1MAPTKMT2A
SCHEMBL24996986 0.88 ALDH1A1 (0.38) —
SCHEMBL24996963 0.86 ALDH1A1 (0.33) MAPTKMT2AHTT
SCHEMBL27891901 0.86 MAPT (0.48) MEN1MAPTKMT2ACYP1A2CYP3A4
SCHEMBL30396708 0.86 KDM1A (0.34) MEN1KMT2AHTTAPPLMNA
SCHEMBL24113139 0.85 CA1 (0.39) MAPTHTTCYP1A2CYP3A4CYP2C9
SCHEMBL30009048 0.85 MAPT (0.38) MEN1MAPTKMT2ALMNANPC1
SCHEMBL30310566 0.85 MAPT (0.40) MEN1MAPTKMT2AHTTCYP1A2
SCHEMBL22620771 0.85 MAPT (0.33) MAPTNPC1PKMRAB9ASMN1; SMN2
SCHEMBL24113456 0.85 MAPT (0.38) MEN1MAPTKMT2ALMNANPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116685576-A Cysteine protease inhibitors and methods of use thereof 美商帕迪斯生物科学公司 2023-09-01 — — CN disclosed
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 — — US disclosed
WO-2021252644-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. (US) 2021-12-16 — — WO 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-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSL, CTSV CTSL 2/4885CTSB 27/4885MEN1 4306/4885

“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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