SCHEMBL2201343

SCHEMBL2201343

O=C1Nc2ccc(F)cc2C1CCC1C(=O)Nc2ccc(F)cc21

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 9/20 0.59
DRD2 P14416 1/20 0.56
DRD1 P21728 1/20 0.56
HTR2A P28223 1/20 0.56
HTR2C P28335 1/20 0.56
ADRA1A P35348 1/20 0.56
HTR6 P50406 1/20 0.56
IDO1 P14902 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
NQO2 P16083 2/20 0.46
HTR1A P08908 1/20 0.44
PGR P06401 1/20 0.41
TP53 P04637 2/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
LMNA P02545 1/20 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
SCHEMBL9651965 0.90 HTR7 (0.54) HTR7DRD2DRD1HTR2AHTR2C
SCHEMBL14996404 0.90 HTR7 (0.54) HTR7DRD2DRD1HTR2AHTR2C
SCHEMBL1543064 0.88 HTR7 (0.51) HTR7DRD2DRD1HTR2AHTR2C
SCHEMBL18854022 0.86 PGR (0.56) HTR7DRD2DRD1HTR2AHTR2C
SCHEMBL2988221 0.86 PGR (0.56) HTR7DRD2DRD1HTR2AHTR2C
SCHEMBL12225622 0.86 HTR7 (0.51) HTR7DRD2DRD1HTR2AHTR2C
SCHEMBL1455904 0.86 HTR7 (0.60) HTR7DRD2DRD1HTR2AHTR2C
SCHEMBL8138050 0.82 HTR7 (0.48) HTR7DRD2DRD1HTR2AHTR2C
SCHEMBL2332233 0.81 HTR7 (0.46) HTR7DRD2DRD1HTR2AHTR2C
SCHEMBL10264450 0.79 HDAC1 (0.56) HTR7DRD2DRD1HTR2AHTR2C

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
US-8455535-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2013-06-04 US disclosed
US-20110257238-A1 Heteroaryl Dihydroindolones as Kinase Inhibitors ALLERGAN, INC. (US) 2011-10-20 US disclosed
US-7977351-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2011-07-12 US disclosed
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS ALLERGAN, INC. 2008-02-21 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 (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-20110257238-A1 Heteroaryl Dihydroindolones as Kinase Inhibitors REN, JAK2, ABL1 HTR7 2220/4885DRD2 2363/4885DRD1 2628/4885
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS REN, JAK2, ABL1 HTR7 2220/4885DRD2 2363/4885DRD1 2628/4885

“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.