SCHEMBL13724976

SCHEMBL13724976

C[C@H]1CCCN([C@H](C(=O)O)c2ccccc2)C1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.62
GAA P10253 2/20 0.60
ALDH1A1 P00352 5/20 0.57
TSHR P16473 4/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2C19 P33261 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
KDM4E B2RXH2 2/20 0.55
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HPGD P15428 3/20 0.46
HRH1 P35367 1/20 0.46
CCR3 P51677 1/20 0.46
KCNH2 Q12809 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ACE P12821 1/20 0.45
MAPK1 P28482 2/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL13724541 1.00 LMNA (0.62) LMNAGAAALDH1A1TSHRCYP3A4
SCHEMBL13725881 0.90 ALDH1A1 (0.56) LMNAGAAALDH1A1TSHRCYP3A4
SCHEMBL13725309 0.90 ALDH1A1 (0.56) LMNAGAAALDH1A1TSHRCYP3A4
SCHEMBL13724849 0.86 ALDH1A1 (0.53) LMNAGAAALDH1A1TSHRCYP3A4
SCHEMBL13724846 0.86 ALDH1A1 (0.53) LMNAGAAALDH1A1TSHRCYP3A4
SCHEMBL13724549 0.84 ALDH1A1 (0.54) LMNAALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL13724839 0.84 ALDH1A1 (0.54) LMNAALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL13724991 0.82 ALDH1A1 (0.50) LMNAGAAALDH1A1TSHRCYP3A4
SCHEMBL13724938 0.82 ALDH1A1 (0.50) LMNAGAAALDH1A1TSHRCYP3A4
SCHEMBL15081882 0.81 LMNA (0.65) LMNAGAAALDH1A1TSHRCYP3A4

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-20090215778-A1 Alpha-substituted Arylmethyl Piperazine Pyrazolo [1,5-alpha]Pyrimidine Amide Derivatives PANACOS PHARMACEUTICALS, INC. (US) 2009-08-27 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-20090215778-A1 Alpha-substituted Arylmethyl Piperazine Pyrazolo [1,5-alpha]Pyrimidine Amide Derivatives THPO, DPYD, TPMT LMNA 4074/4885GAA 831/4885ALDH1A1 116/4885

“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.