SCHEMBL21887248

SCHEMBL21887248

CC(C)N1CCC2(CC1)c1cccnc1C[C@H]2N

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.40
PTPN11 Q06124 5/20 0.36
KCNH2 Q12809 1/20 0.36
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM1A O60341 1/20 0.32
GAA P10253 1/20 0.32
HTR2B P41595 2/20 0.31
P2RY1 P47900 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
PDK2 Q15119 1/20 0.31
CXCR4 P61073 1/20 0.31

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
SCHEMBL22393722 1.00 CYP2D6 (0.40) CYP2D6PTPN11KCNH2KDM4EMEN1
SCHEMBL21845242 0.85 PTPN11 (0.39) PTPN11KCNH2KDM1A
SCHEMBL21887293 0.83 KCNH2 (0.41) PTPN11KCNH2KDM1A
SCHEMBL24088870 0.83 KCNH2 (0.41) PTPN11KCNH2KDM1A
SCHEMBL21887245 0.80 PTPN11 (0.46) CYP2D6PTPN11KCNH2KDM4EMEN1
SCHEMBL21887246 0.80 CYP2D6 (0.36) CYP2D6PTPN11
SCHEMBL22393723 0.80 CYP2D6 (0.36) CYP2D6PTPN11
SCHEMBL21887249 0.79 CYP2D6 (0.49) CYP2D6PTPN11KCNH2KDM1AHRH3
SCHEMBL25564816 0.75 CYP2D6 (0.38) CYP2D6PTPN11
SCHEMBL21845230 0.75 CYP2D6 (0.35) CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167134-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS NIKANG THERAPEUTICS, INC. 2023-06-01 US disclosed
US-20230167134-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS NIKANG THERAPEUTICS, INC. 2023-06-01 US disclosed
US-20210188876-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS NIKANG THERAPEUTICS, INC. 2021-06-24 US disclosed
US-11034705-B2 Fused tricyclic ring derivatives as Src homology-2 phosphate inhibitors NIKANG THERAPEUTICS, INC. (US) 2021-06-15 US disclosed
US-20210040122-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS NIKANG THERAPEUTICS, INC. 2021-02-11 US disclosed
US-20200115389-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATASE INHIBITORS NIKANG THERAPEUTICS, INC. 2020-04-16 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 (5 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-20230167134-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS SRC, PTPRCAP, PTPRC CYP2D6 4469/4885PTPN11 32/4885KCNH2 4269/4885
US-11034705-B2 Fused tricyclic ring derivatives as Src homology-2 phosphate inhibitors SRC, PTPRCAP, PTPRC CYP2D6 4469/4885PTPN11 32/4885KCNH2 4269/4885
US-20200115389-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATASE INHIBITORS SRC, PTPRCAP, PTPRC CYP2D6 4506/4885PTPN11 27/4885KCNH2 4293/4885
US-20210188876-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS SRC, PTPRCAP, PTPRC CYP2D6 4469/4885PTPN11 32/4885KCNH2 4269/4885
US-20210040122-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS SRC, PTPRCAP, PTPRC CYP2D6 4469/4885PTPN11 32/4885KCNH2 4269/4885

“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.