SCHEMBL22914768

SCHEMBL22914768

CC(C)(C)OC(=O)N1CC2(CCN(c3ccc(C#N)cc3)C2)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 2/20 0.54
GPR119 Q8TDV5 5/20 0.47
GPR183 P32249 1/20 0.47
RET P07949 2/20 0.46
CYP11B2 P19099 1/20 0.45
KCNH2 Q12809 1/20 0.44
CYP3A4 P08684 3/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP1A2 P05177 1/20 0.44
TSHR P16473 1/20 0.44
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
CYP2D6 P10635 2/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
AR P10275 1/20 0.42

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
SCHEMBL18357677 0.93 EGLN2 (0.54) EGLN2GPR119GPR183RETCYP11B2
SCHEMBL484627 0.91 CYP11B2 (0.53) EGLN2GPR119GPR183RETCYP11B2
SCHEMBL22914845 0.90 EGLN2 (0.63) EGLN2GPR119GPR183RETJAK2
SCHEMBL22914827 0.89 EGLN2 (0.52) EGLN2GPR119GPR183RETCYP3A4
SCHEMBL31276408 0.85 NPSR1 (0.51) GPR119CYP11B2CYP3A4CYP2C9CYP2C19
SCHEMBL21522226 0.84 RET (0.58) EGLN2GPR119RETCYP11B2
SCHEMBL22914839 0.83 CYP3A4 (0.55) KCNH2CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL38662223 0.82 CYP3A4 (0.62) CYP11B2CYP3A4CYP2C9CYP2C19CYP1A2
SCHEMBL2471189 0.81 MAPT (0.62) EGLN2GPR119RETCYP2C19TSHR
SCHEMBL31342184 0.81 HTT (0.54) GPR119GPR183CYP11B2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230022770-A1 NOVEL PYRIDAZINES BOEHRINGER INGELHEIM INT (DE) 2023-01-26 US disclosed
US-20210024492-A1 NOVEL PYRIDAZINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-01-28 US disclosed
WO-2021013832-A1 1-(6-(METHOXY)PYRIDAZIN-3-YL)CYCLOPROPANE-1-CARBOXAMIDE DERIVATIVES AS AUTOTAXIN (ATX) MODULATORS FOR THE TREATMENT OF INFLAMMATORY AIRWAY DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-01-28 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-20210024492-A1 NOVEL PYRIDAZINES ENPP2, PLPBP, PRDX6 EGLN2 4307/4885GPR119 1166/4885GPR183 1779/4885
US-20230022770-A1 NOVEL PYRIDAZINES ENPP2, PLPBP, PRDX6 EGLN2 4307/4885GPR119 1166/4885GPR183 1779/4885

“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.