SCHEMBL21774333

SCHEMBL21774333

Cc1cc(OCOC(=O)c2ccccc2O)n(-c2ccccc2)n1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 3/20 0.49
▸ MAPT P10636 4/20 0.49
▸ TP53 P04637 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ STAT1 P42224 1/20 0.47
▸ TDP1 Q9NUW8 4/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ GAA P10253 1/20 0.46
▸ SPR P35270 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ ATM Q13315 1/20 0.44
▸ POLB P06746 1/20 0.42

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
SCHEMBL21774132 0.86 MAPT (0.42) NTRK1MAPTTP53LMNASTAT1
SCHEMBL21774330 0.85 KMT2A (0.59) NTRK1MAPTTP53LMNASTAT1
SCHEMBL21774128 0.85 MAPT (0.44) NTRK1MAPTTP53LMNASTAT1
SCHEMBL21774344 0.84 MAPT (0.53) MAPTTP53LMNASTAT1TDP1
SCHEMBL21775658 0.83 KMT2A (0.50) MAPTTP53LMNASTAT1TDP1
SCHEMBL21774298 0.82 MAPT (0.57) MAPTTP53LMNASTAT1TDP1
SCHEMBL21774127 0.82 MAPT (0.52) MAPTTP53LMNASTAT1TDP1
SCHEMBL21774133 0.82 MAPT (0.49) NTRK1MAPTLMNASTAT1TDP1
SCHEMBL21774381 0.81 KMT2A (0.51) NTRK1MAPTTP53LMNASTAT1
SCHEMBL21774299 0.80 ALDH1A1 (0.49) NTRK1MAPTTP53LMNASTAT1

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
US-11692004-B2 Substituted pyrazole compound, preparation method therefor, pharmaceutical composition and medical use thereof JIANGSU VANGUARD PHARMACEUTICAL CO., LTD. (CN) 2023-07-04 — — US disclosed
US-11692004-B2 Substituted pyrazole compound, preparation method therefor, pharmaceutical composition and medical use thereof JIANGSU VANGUARD PHARMACEUTICAL CO., LTD. (CN) 2023-07-04 — — US disclosed
WO-2020038279-A1 SUBSTITUTED PYRAZOLE COMPOUND, AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION, AND USE THEREOF 天津谷堆生物医药科技有限公司 2020-02-27 — — 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-11692004-B2 Substituted pyrazole compound, preparation method therefor, pharmaceutical composition and medical use thereof FARS2, GOT2, HADHB NTRK1 2744/4885MAPT 856/4885TP53 695/4885

“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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