SCHEMBL22016224

SCHEMBL22016224

CCNC1CCC(F)(F)C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.38
IDH1 O75874 7/20 0.32
EPHX2 P34913 1/20 0.32
IDH2 P48735 2/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
OPRL1 P41146 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
SCHEMBL23765416 1.00 KCNH2 (0.38) KCNH2IDH1EPHX2IDH2GRIN2D
SCHEMBL24437109 1.00 KCNH2 (0.38) KCNH2IDH1EPHX2IDH2GRIN2D
SCHEMBL18927996 0.88 KCNH2 (0.35) KCNH2
SCHEMBL17778101 0.86 KCNH2 (0.40) KCNH2IDH1EPHX2
SCHEMBL23987150 0.86 KCNH2 (0.34) KCNH2
SCHEMBL13944829 0.82 IDH1 (0.33) IDH1EPHX2IDH2
SCHEMBL18236646 0.81
SCHEMBL23132219 0.81 IDH1 (0.35) IDH1EPHX2IDH2
SCHEMBL25590766 0.77 GNAI3 (0.49)
SCHEMBL16748107 0.76 KCNH2 (0.39) KCNH2EPHX2GRIN2DGRIN3BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024020034-A1 CBL-B INHIBITORS AND METHODS OF USE THEREOF ARCUS BIOSCIENCES, INC. (US) 2024-01-25 WO disclosed
WO-2023072273-A1 POLYCYCLIC COMPOUND AS CBL-B INHIBITOR 先声再明医药有限公司 2023-05-04 WO disclosed
US-20230041518-A1 QUINOLINE DERIVATIVES GILEAD SCIENCES, INC. 2023-02-09 US disclosed
US-11116760-B2 Quinoline derivatives GILEAD SCIENCES, INC. (US) 2021-09-14 US disclosed
US-20200155538-A1 QUINOLINE DERIVATIVES GILEAD SCIENCES, INC. 2020-05-21 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 (3 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-20230041518-A1 QUINOLINE DERIVATIVES CFTR, NQO1, IRF3 KCNH2 1354/4885IDH1 726/4885EPHX2 3262/4885
US-20200155538-A1 QUINOLINE DERIVATIVES CFTR, NQO1, IRF3 KCNH2 1354/4885IDH1 726/4885EPHX2 3262/4885
US-11116760-B2 Quinoline derivatives CFTR, NQO1, IRF3 KCNH2 1354/4885IDH1 726/4885EPHX2 3262/4885

“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.