SCHEMBL3788404

SCHEMBL3788404

COc1nn(C(C)(C)C)c2ncnc(N)c12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 16/20 0.57
ABL1 P00519 10/20 0.57
EGFR P00533 4/20 0.57
KDR P35968 3/20 0.57
MTOR P42345 2/20 0.57
HCK P08631 2/20 0.57
PIK3CD O00329 2/20 0.57
PIK3CA P42336 2/20 0.57
PIK3CB P42338 2/20 0.57
PIK3CG P48736 2/20 0.57
PRKDC P78527 2/20 0.57
EPHB4 P54760 1/20 0.57
BLK P51451 3/20 0.56
BTK Q06187 3/20 0.56
ERBB2 P04626 2/20 0.56
JAK3 P52333 1/20 0.56
RIPK2 O43353 3/20 0.55
FYN P06241 3/20 0.55
CSNK1D P48730 3/20 0.55
RET P07949 3/20 0.55

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
SCHEMBL23692504 0.85 SRC (0.44) SRCABL1EGFRKDRMTOR
SCHEMBL24005647 0.84 SRC (0.53) SRCABL1EGFRKDRMTOR
SCHEMBL13020110 0.81 SRC (0.53) SRCABL1EGFRKDRMTOR
SCHEMBL21372077 0.81 SRC (0.41) SRCABL1EGFRKDRMTOR
SCHEMBL13019879 0.81 SRC (0.58) SRCABL1EGFRKDRMTOR
SCHEMBL3782929 0.81 SRC (0.58) SRCABL1EGFRKDRMTOR
SCHEMBL3779332 0.80 SRC (0.62) SRCABL1EGFRKDRMTOR
SCHEMBL13019650 0.80 SRC (0.64) SRCABL1EGFRKDRMTOR
SCHEMBL3788099 0.80 SRC (0.57) SRCABL1EGFRKDRMTOR
SCHEMBL13019894 0.79 SRC (0.53) SRCABL1EGFRKDRMTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382932-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2023-11-30 US disclosed
US-20230382932-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2023-11-30 US disclosed
US-20210230196-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2021-07-29 US disclosed
US-10968242-B2 Cyclopentane-based modulators of STING (stimulator of interferon genes) PFIZER INC. (US) 2021-04-06 US disclosed
US-20200102334-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2020-04-02 US disclosed
US-20190284216-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) PFIZER INC. (US) 2019-09-19 US disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 US disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 US disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 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 (6 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-20210230196-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS SRC 3775/4885ABL1 2703/4885EGFR 2568/4885
US-20190284216-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS SRC 3775/4885ABL1 2703/4885EGFR 2568/4885
US-20230382932-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS SRC 3775/4885ABL1 2703/4885EGFR 2568/4885
US-20200102334-A1 Cyclopentane-Based Modulators of STING (Stimulator of Interferon Genes) STING1, IRF3, CGAS SRC 3775/4885ABL1 2703/4885EGFR 2568/4885
US-10968242-B2 Cyclopentane-based modulators of STING (stimulator of interferon genes) STING1, IRF3, CGAS SRC 3775/4885ABL1 2703/4885EGFR 2568/4885
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING RAB1A, COPB1, GOLT1B SRC 1332/4885ABL1 1725/4885EGFR 3921/4885

“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.