SCHEMBL25097625

SCHEMBL25097625

CSc1ccc2c(C(C)=O)nn(CC(=O)O)c2c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.39
▸ ALOX15 P16050 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ AKR1B1 P15121 2/20 0.36
▸ KMO O15229 1/20 0.35
▸ CFD P00746 7/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ SLC22A12 Q96S37 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ ROCK1 Q13464 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C19 P33261 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
SCHEMBL25097224 0.91 HSD17B10 (0.41) HSD17B10ALOX15LMNAAKR1B1CFD
SCHEMBL25097124 0.86 KDM4E (0.43) HSD17B10LMNACFDSMN1; SMN2ALDH1A1
SCHEMBL18554320 0.83 ESR1 (0.42) HSD17B10ALOX15LMNAKMOCFD
SCHEMBL29781847 0.79 HSD17B10 (0.61) HSD17B10ALOX15LMNACFDROCK1
SCHEMBL12481560 0.79 HSD17B10 (0.61) HSD17B10ALOX15LMNACFDROCK1
SCHEMBL12480012 0.78 CFD (0.48) HSD17B10LMNACFDPTGDR2ALDH1A1
SCHEMBL29544970 0.77 CFD (0.46) CFD
SCHEMBL18555224 0.77 CFD (0.46) CFD
SCHEMBL18549496 0.75 CFD (0.47) HSD17B10ALOX15LMNACFDSMN1; SMN2
SCHEMBL13967356 0.75 CFD (0.50) CFD

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-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-03-09 — — 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-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH HSD17B10 2012/4885ALOX15 218/4885LMNA 1931/4885

“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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