SCHEMBL7718009

SCHEMBL7718009

FC(F)(F)COc1ccc(NNc2ccc(N3CCCC4CCCCC43)c(Cl)c2)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
ALDH1A1 P00352 5/20 0.33
HTR2A P28223 1/20 0.33
IDO1 P14902 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
PPARG P37231 2/20 0.32
PPARD Q03181 2/20 0.32
PPARA Q07869 2/20 0.32
LMNA P02545 1/20 0.32
EPHX2 P34913 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL7718013 0.87 ALDH1A1 (0.38) MAPTALDH1A1HTR2ASMN1; SMN2POLB
SCHEMBL14504016 0.68 HPGD (0.36) MAPTALDH1A1IDO1SMN1; SMN2GAA
SCHEMBL6819782 0.67 ALDH1A1 (0.53) MAPTALDH1A1SMN1; SMN2POLBMEN1
Hydrochloric Acid SCHEMBL28013048 0.66 ALDH1A1 (0.43) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL6815112 0.65 ALDH1A1 (0.46) MAPTALDH1A1IDO1POLBMEN1
SCHEMBL7718012 0.64 ALDH1A1 (0.36) MAPTALDH1A1HTR2ASMN1; SMN2POLB
SCHEMBL6819441 0.63 ALDH1A1 (0.52) MAPTALDH1A1SMN1; SMN2MEN1GAA
SCHEMBL1110665 0.62 ALDH1A1 (0.49) MAPTALDH1A1MEN1GAAKMT2A
SCHEMBL1110664 0.62 ALDH1A1 (0.49) MAPTALDH1A1MEN1GAAKMT2A
SCHEMBL1110662 0.62 ALDH1A1 (0.49) MAPTALDH1A1MEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020026055-A1 Aminopyridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION 2002-02-28 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-20020026055-A1 Aminopyridine-containing thiourea inhibitors of herpes viruses TK1, TPMT, CXCR6 MAPT 4129/4885ALDH1A1 3601/4885HTR2A 4410/4885

“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.