SCHEMBL8151174

SCHEMBL8151174

Fc1ccc(C2=NCCCC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHRNB4 P30926 12/20 0.64
▸ CHRNA3 P32297 12/20 0.64
▸ CHRNA7 P36544 2/20 0.46
▸ NPC1 O15118 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ MAPK14 Q16539 1/20 0.41

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
SCHEMBL24414772 0.94 CHRNB4 (0.55) CHRNB4CHRNA3CHRNA7NPC1TP53
SCHEMBL16098695 0.79 CHRNB4 (0.66) CHRNB4CHRNA3CHRNA7NPC1RAB9A
SCHEMBL24233984 0.79 CHRNB4 (0.64) CHRNB4CHRNA3CHRNA7TP53ALDH1A1
SCHEMBL895500 0.78 CHRNB4 (1.00) CHRNB4CHRNA3CHRNA7RAB9AALDH1A1
SCHEMBL19253727 0.78 CHRNB4 (0.63) CHRNB4CHRNA3CHRNA7NPC1RAB9A
SCHEMBL6797483 0.77 CHRNB4 (0.96) CHRNB4CHRNA3CHRNA7RAB9AALDH1A1
SCHEMBL4967805 0.74 CHRNB4 (0.57) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2
SCHEMBL17353143 0.73 CHRNB4 (0.56) CHRNB4CHRNA3CHRNA7NPC1RAB9A
SCHEMBL4693339 0.72 CHRNB4 (0.55) CHRNB4CHRNA3CHRNA7NPC1TP53
SCHEMBL15665457 0.72 CHRNB4 (0.55) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2

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-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 — — US disclosed
CN-117802177-A Method for synthesizing single chiral 2-aryl substituted nitrogen heterocyclic derivative by imine reductase catalysis and application thereof 南京药石科技股份有限公司 2024-04-02 — — CN disclosed
US-20220127256-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2022-04-28 — — US disclosed
CN-109988091-B Preparation method of imine compound 苏州大学 2022-03-18 — — CN disclosed
US-8580956-B2 Gamma secretase modulators MERCK SHARP & DOHME CORP. (US) 2013-11-12 — — US disclosed
US-8580956-B2 Gamma secretase modulators MERCK SHARP & DOHME CORP. (US) 2013-11-12 — — US disclosed
US-20100255005-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2010-10-07 — — US disclosed
US-20100255005-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2010-10-07 — — US disclosed
WO-2008153792-A2 GAMMA SECRETASE MODULATORS SCHERING CORPORATION (US) 2008-12-18 — — 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 (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-20100255005-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 CHRNB4 162/4885CHRNA3 114/4885CHRNA7 209/4885
US-20220127256-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CHRNB4 3299/4885CHRNA3 2163/4885CHRNA7 1575/4885
US-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CHRNB4 3299/4885CHRNA3 2163/4885CHRNA7 1575/4885

“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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