SCHEMBL19962910

SCHEMBL19962910

CCCn1cc(-n2cc(-c3ccc(OCC(C)C)cc3F)cn2)ccc1=O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 2/20 0.40
▸ NR3C1 P04150 1/20 0.37
▸ GRM4 Q14833 6/20 0.36
▸ MCHR1 Q99705 1/20 0.35
▸ CREBBP Q92793 1/20 0.34
▸ SCN5A Q14524 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ NPY5R Q15761 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
SCHEMBL19962892 0.89 MELK (0.40) MELKNR3C1GRM4MCHR1SCN5A
SCHEMBL19962916 0.85 RIPK2 (0.41) MELKGRM4MCHR1
SCHEMBL19962946 0.82 MELK (0.40) MELKNR3C1BRD4NPY5R
SCHEMBL19521380 0.81 MELK (0.38) MELKNR3C1CREBBPTSHRNPY5R
SCHEMBL19962963 0.81 GABRA2 (0.41) MELKNR3C1CREBBPNPY5R
SCHEMBL19962883 0.80 MELK (0.40) MELKNR3C1GRM4
SCHEMBL21130659 0.78 GABRA2 (0.37) MELKNR3C1CREBBPSCN9ANPY5R
SCHEMBL19962994 0.77 NR3C1 (0.39) NR3C1GRM4MCHR1
SCHEMBL19962925 0.76 NR3C1 (0.39) MELKNR3C1GRM4MCHR1
SCHEMBL19541542 0.76 PGR (0.39) MELKNR3C1BRD4

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 MELK 1854/4885NR3C1 1014/4885GRM4 3961/4885
US-20190194167-A1 DI-SUBSTITUTED PYRAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASES SREBF1, SREBF2, CYP27A1 MELK 1854/4885NR3C1 1014/4885GRM4 3961/4885

“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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