SCHEMBL20161833

SCHEMBL20161833

CC(C)NC1CCCN(C(C)C)CCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.39
CYP2D6 P10635 2/20 0.39
KAT2B Q92831 1/20 0.36
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KCNH2 Q12809 1/20 0.34
DPP4 P27487 1/20 0.34
KDM4E B2RXH2 2/20 0.33
KDM1A O60341 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ROCK2 O75116 1/20 0.31
ROCK1 Q13464 1/20 0.31
CDC42BPB Q9Y5S2 1/20 0.31
DRD2 P14416 1/20 0.30
DRD3 P35462 1/20 0.30
CHRNA7 P36544 1/20 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
SCHEMBL15803260 0.96 HRH3 (0.41) HRH3CYP2D6KAT2BGAAL3MBTL1
SCHEMBL2600362 0.88 HRH3 (0.44) HRH3CYP2D6KCNH2KDM1AALDH1A1
SCHEMBL21100844 0.87 KAT2B (0.43) HRH3CYP2D6KAT2BGAAKCNH2
SCHEMBL21423874 0.87 KAT2B (0.43) HRH3CYP2D6KAT2BGAAKCNH2
SCHEMBL14453905 0.87 KAT2B (0.43) HRH3CYP2D6KAT2BGAAKCNH2
SCHEMBL24467174 0.82 KAT2B (0.36) HRH3CYP2D6KAT2BKCNH2KDM4E
SCHEMBL18772695 0.80 CYP2D6 (0.33) HRH3CYP2D6KAT2BKDM1AALDH1A1
SCHEMBL22254765 0.78 KDM1A (0.45) HRH3CYP2D6KAT2BL3MBTL1KDM1A
SCHEMBL19623362 0.78 KDM1A (0.38) HRH3CYP2D6KAT2BKDM4EKDM1A
SCHEMBL19243860 0.78 KDM1A (0.38) HRH3CYP2D6KAT2BKDM4EKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11897874-B2 Compounds and methods for modulating Interleukin-2-inducible T-cell kinase CORVUS PHARMACEUTICALS, INC. (US) 2024-02-13 US disclosed
EP-3534899-B1 COMPOUNDS AND METHODS FOR MODULATING INTERLEUKIN-2-INDUCIBLE T-CELL KINASE CORVUS PHARMACEUTICALS INC (US) 2022-06-01 EP disclosed
WO-2018089261-A2 COMPOUNDS AND METHODS FOR MODULATING INTERLEUKIN-2-INDUCIBLE T-CELL KINASE CORVUS PHARMACEUTICALS, INC. (US) 2018-05-17 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-11897874-B2 Compounds and methods for modulating Interleukin-2-inducible T-cell kinase IL2, NFATC1, IL2RA HRH3 1227/4885CYP2D6 4530/4885KAT2B 940/4885

“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.