SCHEMBL4077162

SCHEMBL4077162

CCOC(=O)c1cnn(-c2cccc(F)c2)c1N

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.77
ALDH1A1 P00352 4/20 0.73
HPGD P15428 2/20 0.73
RAB9A P51151 3/20 0.66
SMN1; SMN2 Q16637 4/20 0.65
TSHR P16473 3/20 0.65
MAPK14 Q16539 1/20 0.62
MAPT P10636 7/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
NPC1 O15118 3/20 0.58
TP53 P04637 2/20 0.58
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
RECQL P46063 1/20 0.54
LMNA P02545 1/20 0.53

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
SCHEMBL31117228 1.00 HTT (0.77) HTTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL11128807 0.88 HTT (0.80) HTTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL31117178 0.88 HTT (0.80) HTTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL10340638 0.87 HTT (1.00) HTTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL31117093 0.87 HTT (1.00) HTTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL10340640 0.87 HTT (0.78) HTTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL16479382 0.86 HTT (0.73) HTTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL1353689 0.86 HTT (0.77) HTTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL15779107 0.86 HTT (0.57) HTTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL18987325 0.86 HTT (0.77) HTTALDH1A1HPGDRAB9ASMN1; SMN2

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118619953-A Dihydropyrazolopyrimidino-pyrido-indol-4-one derivative and application thereof 新疆工程学院 2024-09-10 CN disclosed
US-11759454-B2 Diazole lactams CHEMOCENTRYX, INC. (US) 2023-09-19 US disclosed
US-11759454-B2 Diazole lactams CHEMOCENTRYX, INC. (US) 2023-09-19 US disclosed
US-20210093613-A1 DIAZOLE LACTAMS CHEMOCENTRYX, INC. 2021-04-01 US disclosed
US-10744118-B2 Diazole lactams CHEMOCENTRYX, INC. (US) 2020-08-18 US disclosed
US-10744118-B2 Diazole lactams CHEMOCENTRYX, INC. (US) 2020-08-18 US disclosed
CN-108484614-B Pyrazolo [3,4-d ] pyrimidine-4 (5H) -ketone derivative and preparation method and application thereof 南开大学 2020-01-14 CN disclosed
EP-2928474-B1 DIAZOLE LACTAMS CHEMOCENTRYX INC (US) 2018-11-14 EP disclosed
EP-2895477-B1 PYRAZOLE CARBOXAMIDE DERIVATIVES AS TAAR MODULATORS FOR USE IN THE TREATMENT OF SEVERAL DISORDERS, SUCH AS DEPRESSION, DIABETES AND PARKINSON'S DISEASE. HOFFMANN LA ROCHE (CH) 2017-11-01 EP disclosed
US-9487501-B2 Pyrazole carboxamide compounds and uses thereof HOFFMANN-LA ROCHE INC. (US) 2016-11-08 US disclosed
WO-2014089495-A1 DIAZOLE LACTAMS CHEMOCENTRYX, INC. (US) 2014-06-12 WO disclosed
WO-2014041007-A1 PYRAZOLE CARBOXAMIDE DERIVATIVES AS TAAR MODULATORS FOR USE IN THE TREATMENT OF SEVERAL DISORDERS, SUCH AS DEPRESSION, DIABETES AND PARKINSON'S DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2014-03-20 WO disclosed
US-8080546-B2 Pyrazolo-pyridinone derivatives and methods of use AMGEN INC. (US) 2011-12-20 US disclosed
US-8080546-B2 Pyrazolo-pyridinone derivatives and methods of use AMGEN INC. (US) 2011-12-20 US disclosed
US-8080546-B2 Pyrazolo-pyridinone derivatives and methods of use AMGEN INC. (US) 2011-12-20 US disclosed
US-20090137582-A1 Pyrazolo-pyridinone derivatives and methods of use AMGEN INC. (US) 2009-05-28 US disclosed
US-20090137582-A1 Pyrazolo-pyridinone derivatives and methods of use AMGEN INC. (US) 2009-05-28 US disclosed
US-20090137582-A1 Pyrazolo-pyridinone derivatives and methods of use AMGEN INC. (US) 2009-05-28 US disclosed
WO-2009055033-A1 PYRAZOLO-PYRIDINONE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2009-04-30 WO disclosed
WO-2009055033-A1 PYRAZOLO-PYRIDINONE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2009-04-30 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 (4 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-20210093613-A1 DIAZOLE LACTAMS CCR1, CCRL2, CCR4 HTT 4748/4885ALDH1A1 923/4885HPGD 1851/4885
US-20090137582-A1 Pyrazolo-pyridinone derivatives and methods of use IL1B, IL1R1, IL1A HTT 4738/4885ALDH1A1 703/4885HPGD 383/4885
US-10744118-B2 Diazole lactams CCR1, CCRL2, CCR4 HTT 4748/4885ALDH1A1 923/4885HPGD 1851/4885
US-11759454-B2 Diazole lactams CCR1, CCRL2, CCR4 HTT 4748/4885ALDH1A1 923/4885HPGD 1851/4885

“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.