SCHEMBL20149641

SCHEMBL20149641

CC(C)(C)N1CC2CC(C1)N2C(=O)OC1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.42
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
EPHX1 P07099 2/20 0.35
CYP19A1 P11511 2/20 0.35
GPR119 Q8TDV5 2/20 0.34
HTT P42858 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NAAA Q02083 2/20 0.33
BCHE P06276 1/20 0.32
KCNK3 O14649 1/20 0.31
KCNK9 Q9NPC2 1/20 0.31
CNR1 P21554 1/20 0.30
CYP2C19 P33261 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
SIGMAR1 Q99720 2/20 0.30

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
SCHEMBL20149639 0.98 ATM (0.44) ATMCHRM2CHRM1CHRM3EPHX1
SCHEMBL20149640 0.85 ATM (0.41) ATMCHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL20154607 0.80 RET (0.40) ATMCHRM2CHRM1CHRM3GPR119
SCHEMBL20148738 0.77 CCR2 (0.36) CYP19A1GPR119CYP2C19L3MBTL1
SCHEMBL12084009 0.75 CHRM1 (0.45) CHRM2CHRM1CHRM3EPHX1CYP19A1
SCHEMBL20152358 0.73 KMT2A (0.33) ATMEPHX1NAAA
SCHEMBL21695511 0.72 RET (0.38) CHRM2CHRM1CHRM3
SCHEMBL12293333 0.72 GPR119 (0.43) CHRM2CHRM1CHRM3EPHX1CYP19A1
SCHEMBL12084278 0.72 CHRM1 (0.45) CHRM2CHRM1CHRM3CYP19A1GPR119
SCHEMBL26881060 0.71 ATM (0.41) ATMCHRM2CHRM1CHRM3SMN1; SMN2

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-20180133213-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 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-20180133213-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF ATM 633/4885CHRM2 3260/4885CHRM1 2284/4885

“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.