SCHEMBL3872027

SCHEMBL3872027

FC(F)(F)c1cc(N2CCCCC2)c2cccc(Cl)c2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 4/20 0.48
MAPT P10636 1/20 0.44
NCF1 P14598 2/20 0.44
PIK3R2 O00459 1/20 0.44
MAPK1 P28482 4/20 0.44
HSD17B10 Q99714 3/20 0.43
HPGD P15428 2/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CNR2 P34972 2/20 0.41
KDM4E B2RXH2 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ADRA2A P08913 1/20 0.40
HTR2C P28335 1/20 0.40
AXL P30530 1/20 0.40
HRH1 P35367 1/20 0.40
HTR2B P41595 1/20 0.40
HTR6 P50406 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40

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
SCHEMBL3867390 0.87 PIK3R2 (0.55) ADRB2MAPTNCF1PIK3R2MAPK1
SCHEMBL2711291 0.87 ADRB2 (0.65) ADRB2MAPTNCF1PIK3R2MAPK1
SCHEMBL3867376 0.81 ADRB2 (0.46) ADRB2MAPTPIK3R2MAPK1HPGD
SCHEMBL2710931 0.78 NT5E (0.48) MAPTHPGDKDM4EL3MBTL1CYP1A2
SCHEMBL3869429 0.77 ALDH1A1 (0.49) MAPTMAPK1HSD17B10HPGDSMN1; SMN2
SCHEMBL14136437 0.74 ADRB2 (0.58) ADRB2NCF1MAPK1HSD17B10HPGD
SCHEMBL11831604 0.73 NR4A2 (0.41) PIK3R2HPGDKDM4ECYP1A2CYP2C19
SCHEMBL2711485 0.73 MAP4K4 (0.41) HPGDKDM4EHRH1HTR2BTSHR
SCHEMBL11836535 0.73 NT5E (0.46) PIK3R2HPGDKDM4ECYP1A2CYP2C19
SCHEMBL2708060 0.73 ADRB2 (0.67) ADRB2MAPTNCF1MAPK1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7601355-B2 Compositions and methods for altering immune function NORTHWESTERN UNIVERSITY (US) 2009-10-13 US disclosed
US-7601355-B2 Compositions and methods for altering immune function NORTHWESTERN UNIVERSITY (US) 2009-10-13 US disclosed
US-7601355-B2 Compositions and methods for altering immune function NORTHWESTERN UNIVERSITY (US) 2009-10-13 US disclosed
WO-2007053189-A2 COMPOSITIONS AND METHODS FOR ALTERING IMMUNE FUNCTION NORTHWESTERN UNIVERSITY (US) 2007-05-10 WO disclosed
US-20070041981-A1 Compositions and methods for altering immune function NORTHWESTERN UNIVERSITY 2007-02-22 US disclosed
US-20070041981-A1 Compositions and methods for altering immune function NORTHWESTERN UNIVERSITY 2007-02-22 US disclosed
US-20070041981-A1 Compositions and methods for altering immune function NORTHWESTERN UNIVERSITY 2007-02-22 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-20070041981-A1 Compositions and methods for altering immune function IL2, ICOS, IFNG ADRB2 2549/4885MAPT 4334/4885NCF1 198/4885

“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.