SCHEMBL22299514

SCHEMBL22299514

O=C(NCc1ccccc1)c1cc2cc3c(-c4ccncc4)n[nH]c3cc2[nH]1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 7/20 0.66
MAPK3 P27361 5/20 0.66
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA9 Q16790 1/20 0.58
ROCK2 O75116 5/20 0.52
ROCK1 Q13464 3/20 0.52
NAMPT P43490 2/20 0.51
KDM4E B2RXH2 1/20 0.51
ITK Q08881 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
GRK2 P25098 2/20 0.48
PRKCA P17252 1/20 0.48
GRK3 P35626 1/20 0.48
GRK7 Q8WTQ7 1/20 0.48
RPS6KA5 O75582 1/20 0.48
MAP4K4 O95819 1/20 0.48
PRKCG P05129 1/20 0.48

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
SCHEMBL22299518 0.84 IDO1 (0.53) MAPK1MAPK3
SCHEMBL20931373 0.82 MAPK1 (0.64) MAPK1MAPK3ROCK2ROCK1NAMPT
SCHEMBL30554359 0.82 MAPK1 (0.64) MAPK1MAPK3ROCK2ROCK1NAMPT
SCHEMBL22299520 0.82 MMP2 (0.48) MAPK1MAPK3KDM4EMEN1KMT2A
SCHEMBL22299399 0.81 IDO1 (0.54) MAPK1MAPK3
SCHEMBL22299507 0.80 MAPK1 (0.45) MAPK1MAPK3DYRK1A
SCHEMBL20916818 0.80 MAPK1 (0.54) MAPK1MAPK3ROCK2ROCK1MEN1
SCHEMBL20916816 0.80 MAPK1 (0.54) MAPK1MAPK3ROCK2ROCK1MEN1
SCHEMBL22299504 0.78 MAPK1 (0.43) MAPK1MAPK3DYRK1A
SCHEMBL22299685 0.76 IDO1 (0.46) MAPK1MAPK3ITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 1/4885MAPK3 14/4885CA12 3522/4885

“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.