SCHEMBL21887281

SCHEMBL21887281

Cc1ccnc2c1OC[C@@H]1C[C@H](F)CN21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 7/20 0.40
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
ALPL P05186 1/20 0.32
PDE10A Q9Y233 1/20 0.31
GRM4 Q14833 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
SCHEMBL24388763 1.00 PTPN11 (0.40) PTPN11HTR2AHTR2CHTR2BALPL
SCHEMBL21845273 0.83 PTPN11 (0.40) PTPN11HTR2AHTR2CHTR2BALPL
SCHEMBL21887237 0.83 PTPN11 (0.40) PTPN11HTR2AHTR2CHTR2BALPL
SCHEMBL21887334 0.83 PTPN11 (0.40) PTPN11HTR2AHTR2CHTR2BALPL
SCHEMBL21887329 0.83 PTPN11 (0.40) PTPN11HTR2AHTR2CHTR2BALPL
SCHEMBL24389194 0.83 PTPN11 (0.38) PTPN11ALPLPDE10AGRM4
SCHEMBL24389199 0.83 PTPN11 (0.38) PTPN11ALPLPDE10AGRM4
SCHEMBL21807519 0.83 PTPN11 (0.38) PTPN11ALPLPDE10AGRM4
SCHEMBL24389059 0.83 PTPN11 (0.38) PTPN11ALPLPDE10AGRM4
SCHEMBL31144797 0.83 PTPN11 (0.38) PTPN11ALPLPDE10AGRM4

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 8 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-20210380604-A1 TRI-SUBSTITUTED HETEROARYL DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS NIKANG THERAPEUTICS, INC. 2021-12-09 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-10894797-B2 Fused tricyclic ring derivatives as SRC homology-2 phosphatase inhibitors NIKANG THERAPEUTICS, INC. (US) 2021-01-19 US disclosed
US-20200277308-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATASE INHIBITORS NIKANG THERAPEUTICS, INC. 2020-09-03 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 (8 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-20200277308-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATASE INHIBITORS SRC, PTPRCAP, PTPRC PTPN11 27/4885HTR2A 3038/4885HTR2C 2787/4885
US-20230167134-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS SRC, PTPRCAP, PTPRC PTPN11 32/4885HTR2A 3073/4885HTR2C 2886/4885
US-10894797-B2 Fused tricyclic ring derivatives as SRC homology-2 phosphatase inhibitors SRC, PTPRCAP, PTPRC PTPN11 27/4885HTR2A 3038/4885HTR2C 2787/4885
US-11034705-B2 Fused tricyclic ring derivatives as Src homology-2 phosphate inhibitors SRC, PTPRCAP, PTPRC PTPN11 32/4885HTR2A 3073/4885HTR2C 2886/4885
US-20200115389-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATASE INHIBITORS SRC, PTPRCAP, PTPRC PTPN11 27/4885HTR2A 3038/4885HTR2C 2787/4885
US-20210380604-A1 TRI-SUBSTITUTED HETEROARYL DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS SRC, PTPRCAP, PTPN2 PTPN11 29/4885HTR2A 2585/4885HTR2C 2714/4885
US-20210188876-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS SRC, PTPRCAP, PTPRC PTPN11 32/4885HTR2A 3073/4885HTR2C 2886/4885
US-20210040122-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATE INHIBITORS SRC, PTPRCAP, PTPRC PTPN11 32/4885HTR2A 3073/4885HTR2C 2886/4885

“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.