SCHEMBL22284231

SCHEMBL22284231

CC(NC(=O)c1nc2cc3c(N4CCOCC4)nn(C(c4ccccc4)(c4ccccc4)c4ccccc4)c3cc2[nH]1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 9/20 0.43
AURKA O14965 2/20 0.41
PDE2A O00408 1/20 0.41
PTGS2 P35354 1/20 0.39
TRPV4 Q9HBA0 1/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
FAAH O00519 1/20 0.36

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
SCHEMBL22284167 1.00 MAPK1 (0.43) MAPK1AURKAPDE2APTGS2TRPV4
SCHEMBL28335693 0.86 PKM (0.39) KDM4EALDH1A1FAAH
SCHEMBL22284233 0.85 PIK3CA (0.39) MAPK1KDM4EALDH1A1FAAH
SCHEMBL20916763 0.83 PTGS2 (0.41) MAPK1PTGS2KDM4EALDH1A1GAA
SCHEMBL20916766 0.83 PTGS2 (0.41) MAPK1PTGS2KDM4EALDH1A1GAA
SCHEMBL20920100 0.81 MAPK1 (0.60) MAPK1AURKA
SCHEMBL20920098 0.81 MAPK1 (0.60) MAPK1AURKA
SCHEMBL22284303 0.80 ROCK2 (0.42) MAPK1PDE2APTGS2ALDH1A1
SCHEMBL30554287 0.80 ROCK2 (0.42) MAPK1PDE2APTGS2ALDH1A1
SCHEMBL22284300 0.80 ROCK2 (0.42) MAPK1PDE2APTGS2ALDH1A1

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
CN-110546150-B Pyrazolyl-containing tricyclic derivatives, preparation method and application thereof 江苏豪森药业集团有限公司 2021-12-21 CN disclosed
EP-3699179-A1 PYRAZOLYL-CONTAINING TRICYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2020-08-26 EP disclosed
US-20200247815-A1 PYRAZOLYL-CONTAINING TRICYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI HANSOH BIOMEDICAL CO., LTD. (CN) 2020-08-06 US disclosed
CN-110546150-A Pyrazolyl-containing tricyclic derivatives, preparation method and application thereof JIANGSU HANSOH PHARMACEUTICAL GROUP CO LTD 2019-12-06 CN 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-20200247815-A1 PYRAZOLYL-CONTAINING TRICYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF MAPK1, MAPK11, MAPK14 MAPK1 1/4885AURKA 2408/4885PDE2A 3605/4885

“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.