SCHEMBL24977816

SCHEMBL24977816

O=S(=O)(Cl)c1cnn(CCC(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FADS1 O60427 2/20 0.39
KMT2A Q03164 1/20 0.35
ROCK1 Q13464 1/20 0.33
SCD5 Q86SK9 1/20 0.32
PTPN11 Q06124 1/20 0.32
LIPC P11150 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL18614149 0.83 NAMPT (0.38) KMT2AROCK1ALDH1A1HSD17B10TDP1
SCHEMBL24977410 0.81 PTPN11 (0.38) KMT2APTPN11ALDH1A1HSD17B10TDP1
SCHEMBL20599590 0.81 KMT2A (0.36) KMT2APTPN11ALDH1A1
SCHEMBL24152939 0.78 L3MBTL1 (0.49) KMT2APTPN11ALDH1A1
SCHEMBL22531333 0.78 KAT6A (0.39) KMT2APTPN11ALDH1A1HSD17B10TDP1
SCHEMBL22531328 0.75 PDK2 (0.37) KMT2APTPN11ALDH1A1HSD17B10TDP1
SCHEMBL2058838 0.75 KMT2A (0.42) KMT2APTPN11ALDH1A1
SCHEMBL2412147 0.74 KMT2A (0.58) KMT2AALDH1A1HSD17B10TDP1
SCHEMBL23850653 0.73 ACHE (0.36) KMT2AROCK1ALDH1A1HSD17B10TDP1
SCHEMBL22531713 0.71 FFAR1 (0.46) KMT2AROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230151016-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-05-18 US disclosed
US-20230151016-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-05-18 US disclosed
US-20230151016-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-05-18 US disclosed
US-11566030-B2 Substituted 2,6-dihydropyrrolo[3,4-c]pyrazoles as pyruvate kinase activators GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-01-31 US disclosed
US-11566030-B2 Substituted 2,6-dihydropyrrolo[3,4-c]pyrazoles as pyruvate kinase activators GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-01-31 US disclosed
US-20220267337-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS GLOBAL BLOOD THERAPEUTICS, INC. 2022-08-25 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 (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-11566030-B2 Substituted 2,6-dihydropyrrolo[3,4-c]pyrazoles as pyruvate kinase activators PDK1, PDK2, PDK3 FADS1 4776/4885KMT2A 1149/4885ROCK1 2761/4885
US-20220267337-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS PDK1, PDK2, PKM FADS1 4801/4885KMT2A 1420/4885ROCK1 2158/4885
US-20230151016-A1 PYRROLIDINE-PYRAZOLES AS PYRUVATE KINASE ACTIVATORS PDK1, PDK2, PKM FADS1 4801/4885KMT2A 1420/4885ROCK1 2158/4885

“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.