SCHEMBL22299665

SCHEMBL22299665

O=C(Cc1cc(F)cc(F)c1)c1cc2cc3c(-c4ccncc4)n[nH]c3cc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.51
IDO1 P14902 11/20 0.49
MAPK1 P28482 6/20 0.42
MAPK3 P27361 2/20 0.39
CDC7 O00311 1/20 0.38
ROCK2 O75116 1/20 0.38
MAP4K4 O95819 1/20 0.38
PIM1 P11309 1/20 0.38
PRKACA P17612 1/20 0.38
CDK2 P24941 1/20 0.38
GSK3B P49841 1/20 0.38
HIPK2 Q9H2X6 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
MAP2K4 P45985 1/20 0.37
MAPK6 Q16659 1/20 0.37

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 0.87 IDO1 (0.53) IDO1MAPK1MAPK3
SCHEMBL22299664 0.85 MAPK1 (0.45) NTRK1IDO1MAPK1MAPK3
SCHEMBL22299399 0.84 IDO1 (0.54) IDO1MAPK1MAPK3
SCHEMBL22299685 0.83 IDO1 (0.46) IDO1MAPK1MAPK3
SCHEMBL22299673 0.82 MAPK1 (0.53) IDO1MAPK1MAPK3
SCHEMBL22299695 0.82 NTRK1 (0.50) NTRK1MAPK1MAPK3CDC7ROCK2
SCHEMBL22299414 0.79 MAPK1 (0.51) IDO1MAPK1
SCHEMBL22299678 0.78 MAPK1 (0.44) IDO1MAPK1MAPK3
SCHEMBL22299669 0.78 MAPK1 (0.44) IDO1MAPK1MAPK3
SCHEMBL22299687 0.78 IDO1 (0.43) IDO1MAPK1MAPK3

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 NTRK1 2066/4885IDO1 2355/4885MAPK1 1/4885

“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.