SCHEMBL6700286

SCHEMBL6700286

CC(C)(C)OC(=O)N1CCc2c1ccnc2N

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 5/20 0.46
KDM1A O60341 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
GPR119 Q8TDV5 3/20 0.39
ADORA1 P30542 1/20 0.39
MPO P05164 1/20 0.39
NR1H2 P55055 1/20 0.39
CHRNA7 P36544 1/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
MAP4K4 O95819 1/20 0.38
SMARCA2 P51531 1/20 0.38
SMARCA4 P51532 1/20 0.38
PBRM1 Q86U86 1/20 0.38
POLB P06746 1/20 0.38
NOTUM Q6P988 1/20 0.37
USP30 Q70CQ3 1/20 0.36

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
SCHEMBL6703864 0.84 POLB (0.48) UCHL1KDM1AGPR119CHRNA7HDAC1
SCHEMBL30955285 0.83 UCHL1 (0.41) UCHL1KDM1AKDM4EMAPTGPR119
SCHEMBL27440590 0.82 UCHL1 (0.41) UCHL1KDM1AKDM4EMAPTGPR119
SCHEMBL27440588 0.82 HDAC1 (0.42) UCHL1KDM1AKDM4EMAPTGPR119
SCHEMBL30955275 0.82 UCHL1 (0.41) UCHL1KDM1AKDM4EMAPTGPR119
SCHEMBL30955272 0.82 HDAC1 (0.42) UCHL1KDM1AKDM4EMAPTGPR119
SCHEMBL27440592 0.81 UCHL1 (0.40) UCHL1KDM1AKDM4EMAPTGPR119
SCHEMBL10277570 0.79 KDM1A (0.39) UCHL1KDM1AGPR119MPONR1H2
SCHEMBL256728 0.78 UCHL1 (0.51) UCHL1KDM1AKDM4EMAPTGPR119
SCHEMBL27440586 0.78 ADORA1 (0.43) UCHL1KDM4EMAPTGPR119ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040235867-A1 Tyrosine kinase inhibitors BILODEAU MARK T (US) 2004-11-25 US disclosed
WO-2003009852-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2003-02-06 WO 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-20040235867-A1 Tyrosine kinase inhibitors ERBB2, TYRO3, TIE1 UCHL1 4240/4885KDM1A 3092/4885KDM4E 2200/4885

“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.