SCHEMBL2061665

SCHEMBL2061665

CCOC(=O)N1C2CCC1c1cc(C(=O)OC)cc(N)c1C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR65 Q8IYL9 2/20 0.38
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 3/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 2/20 0.38
MAPT P10636 2/20 0.38
PTGER4 P35408 1/20 0.37
HSD17B10 Q99714 2/20 0.37
TSHR P16473 1/20 0.37
ALOX15 P16050 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CHRM1 P11229 5/20 0.35
HTT P42858 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
GRM5 P41594 1/20 0.34
USP2 O75604 1/20 0.34
GLA P06280 1/20 0.33

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
SCHEMBL2060825 0.83 MAPT (0.39) GPR65KDM4EALDH1A1HPGDNPC1
SCHEMBL2062840 0.72 GRM5 (0.37) SMN1; SMN2CHRM1CHRM4CHRM5GRM5
SCHEMBL20425561 0.71 TSHR (0.45) TSHRCHRM1CHRM4CHRM5GRM5
SCHEMBL8187989 0.71 ATM (0.37) GPR65KDM4EALDH1A1HPGDHSD17B10
SCHEMBL2060555 0.69 SIRT6 (0.40) ALDH1A1HPGDMAPTSMN1; SMN2NPSR1
SCHEMBL884784 0.68 CHRM1 (0.42) ALDH1A1NPC1RAB9ACHRM1CHRM4
SCHEMBL20425643 0.68 OPRM1 (0.40) ALDH1A1CHRM1CHRM4CHRM5GRM5
SCHEMBL2060564 0.68 CHRM1 (0.43) ALDH1A1SMN1; SMN2CHRM1CHRM4CHRM5
SCHEMBL4095011 0.68 ALDH1A1 (0.50) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL11360559 0.67 CHRM1 (0.36) GPR65ALDH1A1CHRM1CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8552186-B2 Fused bicyclic derivatives of 2,4-diaminopyrimidine as ALK and c-MET inhibitors CEPHALON, INC. (US) 2013-10-08 US disclosed
US-20120165519-A1 Fused Bicyclic Derivatives of 2,4-Diaminopyrimidine as ALK and c-MET Inhibitors CEPHALON, INC. (US) 2012-06-28 US disclosed
US-8148391-B2 Fused bicyclic derivatives of 2,4-diaminopyrimidine as ALK and c-Met inhibitors CEPHALON, INC. (US) 2012-04-03 US disclosed
US-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS CEPHALON, INC. (US) 2009-09-03 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 (2 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-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS ALK, MET, RET GPR65 1409/4885KDM4E 729/4885ALDH1A1 77/4885
US-20120165519-A1 Fused Bicyclic Derivatives of 2,4-Diaminopyrimidine as ALK and c-MET Inhibitors ALK, MET, RET GPR65 1409/4885KDM4E 729/4885ALDH1A1 77/4885

“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.