SCHEMBL17723306

SCHEMBL17723306

Cc1cc(F)cc(C)c1[C@H](C)Nc1ccc(C(C)C)nn1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 3/20 0.33
▸ NTRK1 P04629 2/20 0.33
▸ GPR55 Q9Y2T6 1/20 0.33
▸ JAK3 P52333 2/20 0.32
▸ PFKFB3 Q16875 1/20 0.32
▸ PSEN1 P49768 4/20 0.31
▸ PSEN2 P49810 4/20 0.31
▸ APH1B Q8WW43 4/20 0.31
▸ NCSTN Q92542 4/20 0.31
▸ APH1A Q96BI3 4/20 0.31
▸ PSENEN Q9NZ42 4/20 0.31
▸ ALK Q9UM73 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
SCHEMBL21555162 0.86 PSEN1 (0.34) NTRK1GPR55PFKFB3PSEN1PSEN2
SCHEMBL17723304 0.84 ALK (0.39) JAK2NTRK1GPR55JAK3PSEN1
SCHEMBL17723367 0.83 PDPK1 (0.38) GPR55PSEN1PSEN2APH1BNCSTN
SCHEMBL20021791 0.81 GPR55 (0.34) NTRK1GPR55PSEN1PSEN2APH1B
SCHEMBL17723324 0.78 PSEN1 (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17723312 0.78 PSEN1 (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL26866964 0.73 HCAR3 (0.38) —
SCHEMBL17723303 0.72 STIM1 (0.40) NTRK1JAK3
SCHEMBL21555155 0.69 GPR55 (0.39) GPR55PSEN1PSEN2APH1BNCSTN
SCHEMBL21734097 0.69 PSEN1 (0.36) PSEN1PSEN2APH1BNCSTNAPH1A

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
US-11117884-B2 Potent gamma-secretase modulators THE GENERAL HOSPITAL CORPORATION (US) 2021-09-14 — — US disclosed
US-20200055840-A1 POTENT GAMMA-SECRETASE MODULATORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-02-20 — — US disclosed
US-10472346-B2 Potent gamma-secretase modulators THE GENERAL HOSPITAL CORPORATION (US) 2019-11-12 — — US disclosed
US-20180093967-A1 POTENT GAMMA-SECRETASE MODULATORS THE GENERAL HOSPITAL CORPORATION 2018-04-05 — — US disclosed
WO-2016070107-A1 POTENT GAMMA-SECRETASE MODULATORS THE GENERAL HOSPITAL CORPORATION (US) 2016-05-06 — — 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 (4 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-20200055840-A1 POTENT GAMMA-SECRETASE MODULATORS BACE1, BACE2, GSAP JAK2 4842/4885NTRK1 1691/4885GPR55 1777/4885
US-10472346-B2 Potent gamma-secretase modulators BACE1, BACE2, APP JAK2 4809/4885NTRK1 2418/4885GPR55 3037/4885
US-11117884-B2 Potent gamma-secretase modulators BACE1, BACE2, GSAP JAK2 4842/4885NTRK1 1691/4885GPR55 1777/4885
US-20180093967-A1 POTENT GAMMA-SECRETASE MODULATORS BACE1, BACE2, APP JAK2 4809/4885NTRK1 2418/4885GPR55 3037/4885

“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.

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