SCHEMBL13344348

SCHEMBL13344348

CCc1nnnn1CCC#N

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 3/20 0.48
TSHR P16473 2/20 0.40
GLA P06280 1/20 0.40
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.33
CYP1A2 P05177 1/20 0.33
GHSR Q92847 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 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
SCHEMBL22069732 0.81 NAALAD2 (0.51) NAALAD2TSHRGLACYP1A2GHSR
SCHEMBL10240204 0.81 ALDH1A1 (0.33) NAALAD2KMT2ALMNACYP1A2ALDH1A1
Hydrochloric Acid SCHEMBL15253870 0.80 NAALAD2 (0.45) NAALAD2TSHRGLAKMT2ALMNA
SCHEMBL7344053 0.79 NAALAD2 (0.52) NAALAD2TSHRGLACYP1A2GHSR
SCHEMBL4403621 0.78 ALDH1A1 (0.44) KMT2ALMNACYP1A2ALDH1A1
SCHEMBL15254266 0.75 NAALAD2 (0.49) NAALAD2TSHRGLAKMT2ALMNA
SCHEMBL13252477 0.75 KMT2A (0.36) KMT2ALMNACYP1A2ALDH1A1GAA
SCHEMBL96932 0.75 KMT2A (0.43) TSHRKMT2ALMNAALDH1A1GAA
SCHEMBL2056129 0.73
SCHEMBL10673194 0.73 GLA (0.42) NAALAD2TSHRGLAKMT2ALMNA

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-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 NAALAD2 1380/4885TSHR 501/4885GLA 4039/4885

“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.