SCHEMBL22857078

SCHEMBL22857078

CCN1CC(Oc2ccccc2C)C1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 10/20 0.42
SLC6A2 P23975 9/20 0.42
SLC6A3 Q01959 9/20 0.42
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
EPHX2 P34913 1/20 0.40
HTR7 P34969 1/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL9683909 0.81 SLC6A4 (0.40) SLC6A4SLC6A2KMT2AALDH1A1
SCHEMBL10260948 0.80 SLC6A4 (0.44) SLC6A4SLC6A2SLC6A3TDP1ALDH1A1
Hydrochloric Acid SCHEMBL9682487 0.79 SLC6A4 (0.39) SLC6A4SLC6A2KMT2AALDH1A1LMNA
SCHEMBL1812729 0.78 SLC6A4 (0.36) SLC6A4CYP2D6
SCHEMBL20012540 0.77 CARM1 (0.47) SLC6A4SLC6A2SLC6A3TDP1ALDH1A1
SCHEMBL20068827 0.76 SSTR4 (0.44) SLC6A4SLC6A2SLC6A3
SCHEMBL20176375 0.76 SLC6A4 (0.55) SLC6A4SLC6A2SLC6A3
SCHEMBL10035281 0.75 SLC6A2 (0.51) SLC6A4SLC6A2SLC6A3ALDH1A1GLA
SCHEMBL10608615 0.74 MCHR1 (0.59) KMT2AMEN1SMN1; SMN2
SCHEMBL20158870 0.73 SLC6A2 (0.40) SLC6A4SLC6A2SLC6A3ALDH1A1GLA

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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-01-05 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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 SLC6A4 3586/4885SLC6A2 4053/4885SLC6A3 1858/4885

“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.