SCHEMBL19962969

SCHEMBL19962969

CCCn1cc(-n2cc(-c3ccc(S(=O)(=O)CC(C)C)cc3Cl)cn2)ccc1=O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 3/20 0.35
▸ GABRA2 P47869 1/20 0.32
▸ NMT1 P30419 1/20 0.31
▸ CREBBP Q92793 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ CCL2 P13500 1/20 0.31
▸ NR3C1 P04150 1/20 0.30
▸ ADORA3 P0DMS8 1/20 0.30
▸ ADORA2A P29274 1/20 0.30
▸ ADORA2B P29275 1/20 0.30
▸ ADORA1 P30542 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30

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
SCHEMBL29993004 0.91 MELK (0.38) MELKGABRA2CREBBPBRD4CCL2
SCHEMBL19951542 0.91 MELK (0.38) MELKGABRA2CREBBPBRD4CCL2
SCHEMBL19962962 0.90 MELK (0.37) MELKGABRA2NMT1CREBBPBRD4
SCHEMBL19962968 0.87 MELK (0.36) MELKGABRA2NMT1CREBBPBRD4
SCHEMBL21130654 0.86 NR3C1 (0.35) MELKCREBBPNR3C1ADORA3ADORA2A
SCHEMBL19962970 0.85 MELK (0.34) MELKBRD4CCL2ADORA3ADORA2A
SCHEMBL19962966 0.83 MELK (0.35) MELKGABRA2KCNH2
SCHEMBL19962903 0.83 TSHR (0.40) ADORA3ADORA2B
SCHEMBL21130655 0.83 MELK (0.32) MELKBRD4CCL2
SCHEMBL19962964 0.82 DRD2 (0.37) MELKGABRA2CREBBPBRD4CCL2

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 1854/4885GABRA2 3372/4885NMT1 2219/4885
US-20190194167-A1 DI-SUBSTITUTED PYRAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASES SREBF1, SREBF2, CYP27A1 MELK 1854/4885GABRA2 3372/4885NMT1 2219/4885

“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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