SCHEMBL14070979

SCHEMBL14070979

CN1CCN(c2ncc(N)cc2F)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.50
HRH4 Q9H3N8 5/20 0.49
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ADRA2C P18825 2/20 0.41
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
PTK2B Q14289 1/20 0.41
ESR2 Q92731 1/20 0.41
RPS6KA3 P51812 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
SCHEMBL19649847 0.84 ALDH1A1 (0.41) SMN1; SMN2MAPTKMT2AMAPK1ALDH1A1
SCHEMBL29739691 0.83 ALDH1A1 (0.43) MAPTKMT2AMAPK1ALDH1A1L3MBTL1
SCHEMBL18334275 0.83 SMN1; SMN2 (0.53) SMN1; SMN2HRH4MAPTKMT2ATSHR
SCHEMBL4675955 0.83 HRH4 (0.56) SMN1; SMN2HRH4MAPTKMT2AMAPK1
SCHEMBL29177180 0.83 ALDH1A1 (0.43) MAPTKMT2AMAPK1ALDH1A1L3MBTL1
SCHEMBL1816828 0.81 HRH4 (0.50) SMN1; SMN2HRH4MAPTKMT2AALDH1A1
Hydrochloric Acid SCHEMBL5381742 0.81 HRH4 (0.54) SMN1; SMN2HRH4MAPTKMT2AMAPK1
SCHEMBL24309237 0.80 SMN1; SMN2 (0.50) SMN1; SMN2HRH4MAPTKMT2ATSHR
SCHEMBL21262632 0.80 SMN1; SMN2 (0.58) SMN1; SMN2HRH4MAPTKMT2ATSHR
SCHEMBL1724026 0.80 KDM4E (0.51) SMN1; SMN2MAPTTSHRALDH1A1KDM4E

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
US-20080214558-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS SUPERGEN, INC. (US) 2008-09-04 US disclosed
US-20080214558-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS SUPERGEN, INC. (US) 2008-09-04 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-20080214558-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS JAK2, JAK1, JAK3 SMN1; SMN2 3735/4885HRH4 1635/4885MAPT 3664/4885

“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.