SCHEMBL30189533

SCHEMBL30189533

CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)C(O)c3ccccc3)[C@H]2SC1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 7/20 0.79
▸ MAPT P10636 7/20 0.79
▸ ALDH1A1 P00352 6/20 0.79
▸ KMT2A Q03164 6/20 0.79
▸ CYP3A4 P08684 4/20 0.79
▸ SLC15A2 Q16348 3/20 0.79
▸ HPGD P15428 3/20 0.79
▸ TDP1 Q9NUW8 3/20 0.79
▸ MAPK1 P28482 2/20 0.79
▸ BLM P54132 2/20 0.79
▸ CYP2C19 P33261 2/20 0.79
▸ ADRA1A P35348 1/20 0.79
▸ HTR2B P41595 1/20 0.79
▸ MEN1 O00255 4/20 0.67
▸ SLC22A6 Q4U2R8 2/20 0.67
▸ SLC22A8 Q8TCC7 2/20 0.67
▸ LMNA P02545 2/20 0.67
▸ ESR1 P03372 1/20 0.67
▸ CACNA1B Q00975 1/20 0.63
▸ APBA1 Q02410 1/20 0.63

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
SCHEMBL11159809 1.00 HSD17B10 (0.79) HSD17B10MAPTALDH1A1KMT2ACYP3A4
SCHEMBL11159811 1.00 HSD17B10 (0.79) HSD17B10MAPTALDH1A1KMT2ACYP3A4
SCHEMBL21594386 0.89 HSD17B10 (0.79) HSD17B10MAPTALDH1A1KMT2ACYP3A4
SCHEMBL14434962 0.89 HSD17B10 (0.79) HSD17B10MAPTALDH1A1KMT2ACYP3A4
Cephalexin Anhydrous SCHEMBL10925361 0.88 HSD17B10 (1.00) HSD17B10MAPTALDH1A1KMT2ACYP3A4
Cephalexin Anhydrous SCHEMBL11569012 0.88 HSD17B10 (1.00) HSD17B10MAPTALDH1A1KMT2ACYP3A4
Cephalexin Anhydrous SCHEMBL11985597 0.88 HSD17B10 (1.00) HSD17B10MAPTALDH1A1KMT2ACYP3A4
Cephalexin Anhydrous SCHEMBL20703090 0.88 HSD17B10 (1.00) HSD17B10MAPTALDH1A1KMT2ACYP3A4
Cephalexin Anhydrous SCHEMBL8481524 0.88 HSD17B10 (1.00) HSD17B10MAPTALDH1A1KMT2ACYP3A4
Cephalexin Anhydrous SCHEMBL6663545 0.88 HSD17B10 (1.00) HSD17B10MAPTALDH1A1KMT2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250338849-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES BASF SE (DE) 2025-11-06 — — US disclosed
US-12054730-B2 Pesticidal genes and methods of use AgBiome, Inc. (US) 2024-08-06 — — US disclosed
US-20240052364-A1 PESTICIDAL GENES AND METHODS OF USE AgBiome, Inc. (US) 2024-02-15 — — US disclosed
US-11839214-B2 Fungicidal mixture comprising substituted pyridines BASF SE (DE) 2023-12-12 — — US disclosed
US-20230284632-A1 PESTICIDAL GENES AND METHODS OF USE AgBiome, Inc. (US) 2023-09-14 — — US disclosed
US-20230279060-A1 PESTICIDAL GENES AND METHODS OF USE AgBiome, Inc. (US) 2023-09-07 — — US disclosed
US-11540520-B2 Pesticidal genes and methods of use AgBiome, Inc. (US) 2023-01-03 — — 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 (2 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-11839214-B2 Fungicidal mixture comprising substituted pyridines ME1, DPM1, TH HSD17B10 1723/4885MAPT 1386/4885ALDH1A1 913/4885
US-20250338849-A1 FUNGICIDAL MIXTURE COMPRISING SUBSTITUTED PYRIDINES ME1, DPM1, ERG28 HSD17B10 1895/4885MAPT 1725/4885ALDH1A1 1040/4885

“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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