SCHEMBL15475205

SCHEMBL15475205

CCOC(=O)c1cnnn1-c1[c]cccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
ALOX12 P18054 1/20 0.40
GABRA1 P14867 4/20 0.40
GABRB2 P47870 4/20 0.40
CYP1A2 P05177 3/20 0.40
GABRA2 P47869 3/20 0.40
CYP3A4 P08684 2/20 0.40
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 2/20 0.40
LMNA P02545 2/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ABCB11 O95342 1/20 0.40
ALDH1A1 P00352 6/20 0.40
TSHR P16473 3/20 0.40
POLB P06746 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NOD2 Q9HC29 1/20 0.39
NOD1 Q9Y239 1/20 0.39
HPGD P15428 2/20 0.39

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
SCHEMBL8156087 0.80 TP53 (0.58) TP53ALOX12GABRB2GABRA2LMNA
SCHEMBL6765042 0.74 KDM4E (0.54) TP53ALOX12GABRB2GABRA2LMNA
SCHEMBL22731945 0.74 HSD11B1 (0.53) LMNAALDH1A1POLBHPGDKDM4E
SCHEMBL29574308 0.74 HSD11B1 (0.53) LMNAALDH1A1POLBHPGDKDM4E
SCHEMBL1648292 0.73 ALDH1A1 (0.40) TP53ALOX12GABRA1GABRB2CYP1A2
SCHEMBL8156170 0.73 IDO1 (0.46) TP53ALOX12CYP1A2CYP3A4CYP2C19
SCHEMBL14711072 0.72 SLC5A1 (0.50) TP53ALOX12ALDH1A1TSHRPOLB
SCHEMBL15474868 0.72 ALDH1A1 (0.53) TP53ALOX12GABRB2CYP1A2GABRA2
SCHEMBL28824021 0.70 LMNA (0.44) TP53ALOX12GABRB2GABRA2LMNA
SCHEMBL136187 0.70 CYP2C9 (0.44) GABRA1GABRB2CYP1A2GABRA2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021006267-A1 SALT OF PYRAZOLE DERIVATIVE AND PREPARATION OF PYRAZOLE DERIVATIVE グリーン・テック株式会社 2021-01-14 WO disclosed
WO-2020235582-A1 PREVENTIVE AND/OR THERAPEUTIC AGENT FOR MOTOR NEURON DISEASE グリーン・テック株式会社 (JP) 2020-11-26 WO disclosed
EP-3323816-A1 NOVEL PYRAZOLE DERIVATIVE Green Tech Co., Ltd. (JP) 2018-05-23 EP disclosed
US-9399635-B2 Pyrazole derivative GREEN TECH CO., LTD. (JP) 2016-07-26 US disclosed
US-20140088029-A1 NOVEL PYRAZOLE DERIVATIVE PHARMA EIGHT CO., LTD. (JP) 2014-03-27 US disclosed
EP-2698368-A1 NOVEL PYRAZOLE DERIVATIVE Pharma Eight Co. Ltd (JP) 2014-02-19 EP 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 (1 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-20140088029-A1 NOVEL PYRAZOLE DERIVATIVE PSEN2, MAPT, PSEN1 TP53 2217/4885ALOX12 3682/4885GABRA1 2039/4885

“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.