SCHEMBL19962992

SCHEMBL19962992

CCCn1cc(-n2cc(-c3ccc(O[C@@H](C)CC)cc3)cn2)ccc1=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK2 P49137 1/20 0.40
▸ NR3C1 P04150 2/20 0.38
▸ MELK Q14680 3/20 0.36
▸ CREBBP Q92793 3/20 0.35
▸ HTR3A P46098 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ NPY5R Q15761 1/20 0.33
▸ ADORA2A P29274 2/20 0.33
▸ ADORA2B P29275 2/20 0.33
▸ ADORA1 P30542 2/20 0.33
▸ MAP4K4 O95819 1/20 0.33
▸ GCGR P47871 3/20 0.32
▸ ADORA3 P0DMS8 1/20 0.32

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
SCHEMBL19962993 1.00 MAPKAPK2 (0.40) MAPKAPK2NR3C1MELKCREBBPHTR3A
SCHEMBL19962974 0.92 MAPKAPK2 (0.41) MAPKAPK2NR3C1MELKCREBBPNPY5R
SCHEMBL19963019 0.90 MAPKAPK2 (0.41) MAPKAPK2NR3C1MELKCREBBPHTR3A
SCHEMBL19951557 0.85 MAPKAPK2 (0.55) MAPKAPK2MELKCREBBPMAPTADORA2A
SCHEMBL19962915 0.85 NR3C1 (0.38) MAPKAPK2NR3C1ADORA2AADORA2BADORA1
SCHEMBL19962989 0.85 NR3C1 (0.38) MAPKAPK2NR3C1ADORA2AADORA2BADORA1
SCHEMBL19521325 0.80 MELK (0.40) MAPKAPK2MELKCREBBPNPY5RADORA2A
SCHEMBL19962886 0.80 NR3C1 (0.34) NR3C1MELKADORA2AADORA2BADORA1
SCHEMBL19962884 0.80 NR3C1 (0.34) NR3C1MELKADORA2AADORA2BADORA1
SCHEMBL19962944 0.80 NR3C1 (0.34) NR3C1MELKADORA2AADORA2BADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339142-B2 Di-substituted pyrazole compounds for the treatment of diseases FGH BIOTECH, INC. (US) 2022-05-24 — — US disclosed
WO-2020132700-A1 METHODS OF USING INHIBITORS OF SREBP IN COMBINATION WITH NICLOSAMIDE AND ANALOGS THEREOF Fgh Biotech Inc. (US) 2020-06-25 — — WO disclosed
US-20190194167-A1 DI-SUBSTITUTED PYRAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASES FGH BIOTECH, INC. 2019-06-27 — — US disclosed
WO-2018049080-A1 DI-SUBSTITUTED PYRAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASES FGH BIOTECH, INC. (US) 2018-03-15 — — 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 (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-11339142-B2 Di-substituted pyrazole compounds for the treatment of diseases SREBF1, SREBF2, CYP27A1 MAPKAPK2 441/4885NR3C1 1014/4885MELK 1854/4885
US-20190194167-A1 DI-SUBSTITUTED PYRAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASES SREBF1, SREBF2, CYP27A1 MAPKAPK2 441/4885NR3C1 1014/4885MELK 1854/4885

“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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