SCHEMBL21410716

SCHEMBL21410716

COC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1nsnc1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FTO Q9C0B1 2/20 0.42
▸ TACR3 P29371 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ S1PR1 P21453 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CAPN1 P07384 4/20 0.39
▸ ATM Q13315 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL22886561 0.95 L3MBTL1 (0.42) FTOTACR3MAPTPOLBTDP1
SCHEMBL22886544 0.88 L3MBTL1 (0.44) FTOMAPTPOLBTDP1S1PR1
SCHEMBL22886426 0.88 FTO (0.42) FTOMAPTPOLBTDP1L3MBTL1
SCHEMBL22886773 0.88 CAPN1 (0.51) TACR3MAPTPOLBTDP1CAPN1
SCHEMBL22886761 0.87 RAB9A (0.40) FTOTACR3MAPTPOLBTDP1
SCHEMBL22886566 0.87 CAPN1 (0.43) CAPN1ALDH1A1
SCHEMBL21854063 0.86 CAPN1 (0.53) CAPN1
SCHEMBL20028431 0.86 CAPN1 (0.53) CAPN1
SCHEMBL22886730 0.84 L3MBTL1 (0.41) FTOL3MBTL1CAPN1ATM
SCHEMBL21411218 0.84 CAPN1 (0.40) MAPTL3MBTL1CAPN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220347173-A1 METHODS OF TREATING LIVER FIBROSIS USING CALPAIN INHIBITORS BLADE THERAPEUTICS INC (US) 2022-11-03 — — US disclosed
EP-3820864-A1 METHODS OF TREATING LIVER FIBROSIS USING CALPAIN INHIBITORS Blade Therapeutics, Inc. (US) 2021-05-19 — — EP disclosed
CN-112703188-A Method for treating liver fibrosis using calpain inhibitor 布莱德治疗公司 2021-04-23 — — CN disclosed
US-20210113560-A1 METHOD OF TREATING FIBROTIC DISEASE BLADE THERAPEUTICS INC (US) 2021-04-22 — — US disclosed
EP-3774737-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF Blade Therapeutics, Inc. (US) 2021-02-17 — — EP disclosed
WO-2021021816-A1 CALPAIN INHIBITORS AND USES THEREOF FOR TREATING NEUROLOGICAL DISORDERS BLADE THERAPEUTICS, INC. (US) 2021-02-04 — — WO disclosed
US-20210009564-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPERTICS INC (US) 2021-01-14 — — US disclosed
CN-112204014-A Calpain modulators and therapeutic uses thereof 布莱德治疗公司 2021-01-08 — — CN disclosed
WO-2019190885-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS, INC. (US) 2019-10-03 — — 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 (3 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-20220347173-A1 METHODS OF TREATING LIVER FIBROSIS USING CALPAIN INHIBITORS CAPNS1, CAPN9, CAPN2 FTO 4667/4885TACR3 3285/4885MAPT 4077/4885
US-20210009564-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN9, CAPN1 FTO 4735/4885TACR3 4071/4885MAPT 483/4885
US-20210113560-A1 METHOD OF TREATING FIBROTIC DISEASE CAPN9, CAPNS1, CAPN1 FTO 4438/4885TACR3 4542/4885MAPT 2905/4885

“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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