SCHEMBL19951552

SCHEMBL19951552

CCCn1cc(-n2cc(-c3cnc(OC(C)C)nc3)cn2)ccc1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 1/20 0.35
▸ CREBBP Q92793 3/20 0.34
▸ MELK Q14680 4/20 0.34
▸ ADORA2A P29274 4/20 0.34
▸ ADORA2B P29275 4/20 0.34
▸ ADORA1 P30542 4/20 0.34
▸ ADORA3 P0DMS8 2/20 0.34
▸ NPY5R Q15761 1/20 0.34
▸ MAPKAPK2 P49137 1/20 0.32
▸ S1PR1 P21453 1/20 0.31
▸ FLT3 P36888 1/20 0.31
▸ SYK P43405 1/20 0.31
▸ AURKB Q96GD4 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ FGFR1 P11362 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
SCHEMBL19962960 0.82 MELK (0.34) NR3C1CREBBPMELKADORA2AADORA2B
SCHEMBL19951556 0.81 MELK (0.38) NR3C1CREBBPMELKADORA2AADORA2B
SCHEMBL19962993 0.79 MAPKAPK2 (0.40) NR3C1CREBBPMELKADORA2AADORA2B
SCHEMBL19962992 0.79 MAPKAPK2 (0.40) NR3C1CREBBPMELKADORA2AADORA2B
SCHEMBL19521401 0.78 GPR55 (0.40) NR3C1CREBBPMELKADORA2AADORA2B
SCHEMBL19521317 0.78 CREBBP (0.38) CREBBPMELKADORA2AADORA2BADORA1
SCHEMBL19962945 0.78 NR3C1 (0.35) NR3C1CREBBPMELKADORA2AADORA2B
SCHEMBL19521337 0.78 CDK4 (0.40) NR3C1CREBBPMELKADORA2AADORA2B
SCHEMBL19963019 0.78 MAPKAPK2 (0.41) NR3C1CREBBPMELKADORA2AADORA2B
SCHEMBL19962974 0.78 MAPKAPK2 (0.41) NR3C1CREBBPMELKADORA2AADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110072861-B Disubstituted pyrazoles for the treatment of diseases FGH生物科技公司 2022-11-11 — — CN disclosed
EP-3510027-B1 DI-SUBSTITUTED PYRAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASES FGH BIOTECH INC (US) 2022-11-02 — — EP disclosed
US-11339142-B2 Di-substituted pyrazole compounds for the treatment of diseases FGH BIOTECH, INC. (US) 2022-05-24 — — US disclosed
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
EP-3510027-A1 DI-SUBSTITUTED PYRAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASES FGH Biotech, Inc. (US) 2019-07-17 — — EP disclosed
US-20190194167-A1 DI-SUBSTITUTED PYRAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASES FGH BIOTECH, INC. 2019-06-27 — — US 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
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 NR3C1 1014/4885CREBBP 136/4885MELK 1854/4885
US-20190194167-A1 DI-SUBSTITUTED PYRAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASES SREBF1, SREBF2, CYP27A1 NR3C1 1014/4885CREBBP 136/4885MELK 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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