SCHEMBL22499429

SCHEMBL22499429

CCNc1nccc(I)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.40
PGK1 P00558 7/20 0.34
MAP4K4 O95819 1/20 0.33
GSK3B P49841 1/20 0.33
MAP4K2 Q12851 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
CYP1A1 P04798 2/20 0.32
CYP1A2 P05177 2/20 0.32
GRM5 P41594 1/20 0.32
LMNA P02545 1/20 0.31
GLP1R P43220 1/20 0.31
PDE10A Q9Y233 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
SCHEMBL21855929 0.79 TNF (0.42) MAP4K4GSK3BKDM4ELMNA
SCHEMBL22440558 0.79 KDM4E (0.39) KDM4EALDH1A1LMNA
SCHEMBL21856005 0.78 UTS2R (0.46) UTS2RGSK3BKDM4EALDH1A1CYP1A2
SCHEMBL19387107 0.78 UTS2R (0.40) UTS2RPGK1MAP4K4KDM4EALDH1A1
SCHEMBL22493746 0.75 IDH1 (0.32) KDM4EALDH1A1HPGDLMNA
SCHEMBL741028 0.75 GOT1 (0.33) ALDH1A1
SCHEMBL29563486 0.74 KDM4E (0.30) KDM4EALDH1A1LMNA
SCHEMBL21920610 0.74 LRRK2 (0.41) MAP4K4KDM4EHPGDGRM5LMNA
SCHEMBL30133420 0.74 CLK4 (0.50) KDM4EALDH1A1HPGD
SCHEMBL24152599 0.74 ACACB (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220289753-A1 SHP2 INHIBITORS IRBM S.P.A. (IT) 2022-09-15 US disclosed
CN-114728935-A SHP2 inhibitor IRBM股份公司 2022-07-08 CN disclosed
EP-4010335-A1 SHP2 INHIBITORS IRBM S.P.A. (IT) 2022-06-15 EP disclosed
EP-3947367-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS Array Biopharma, Inc. (US) 2022-02-09 EP disclosed
WO-2021028362-A1 SHP2 INHIBITORS IRBM S.P.A. (IT) 2021-02-18 WO disclosed
WO-2021028362-A1 SHP2 INHIBITORS IRBM S.P.A. (IT) 2021-02-18 WO disclosed
WO-2020201991-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2020-10-08 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-20220289753-A1 SHP2 INHIBITORS PTPN1, PTPN2, PTPN7 UTS2R 2504/4885PGK1 1199/4885MAP4K4 677/4885

“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.