SCHEMBL3054039

SCHEMBL3054039

CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(C=Cc2cc[n+](C)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 2/20 0.55
▸ CHRM4 P08173 2/20 0.55
▸ CHRM5 P08912 2/20 0.55
▸ CHRM1 P11229 2/20 0.55
▸ CHRM3 P20309 2/20 0.55
▸ KDM4A O75164 4/20 0.55
▸ KDM2A Q9Y2K7 4/20 0.55
▸ ALDH1A1 P00352 3/20 0.53
▸ MAPT P10636 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ ALPG P10696 1/20 0.53
▸ THRB P10828 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ GFER P55789 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ INSR P06213 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.44

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
SCHEMBL7619893 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10341093 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10340951 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10340879 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6653604 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL16183109 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10340880 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL3054036 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10341094 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL16183107 1.00 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970325-B1 LYSOPHOSPHATIDIC ACID DETECTION UNIV PORTLAND STATE (US) 2017-09-27 — — EP claimed
US-20100222673-A1 INTRA-OPERATIVE HEAD AND NECK NERVE MAPPING NOVADAQ TECHNOLOGIES INC. (CA) 2010-09-02 — — US claimed
WO-2007016790-A1 INTRA-OPERATIVE HEAD & NECK NERVE MAPPING NOVADAQ TECHNOLOGIES, INC. (CA) 2007-02-15 — — WO claimed
EP-1039834-B1 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP (US) 2005-09-28 — — EP claimed
EP-4702841-A1 MICROCAPSULES FOR CONTROLLED RELEASE IN ENCLOSED MEDIA Centre Scientifique Et Technique Du Batiment (CSTB) (FR) 2026-03-04 — — EP disclosed
US-20230181744-A1 COMPOUND FOR PREVENTING OR TREATING LIPID METABOLISM-RELATED DISEASES FUDAN UNIVERSITY (CN) 2023-06-15 — — US disclosed
EP-4121774-A1 MEANS AND METHOD FOR DETECTING ABERRANT ERYTHROBLASTS Premise Biosystems Co., Ltd. (TH) 2023-01-25 — — EP disclosed
WO-2021186032-A1 MEANS AND METHOD FOR DETECTING ABERRANT ERYTHROBLASTS PREMISE BIOSYSTEMS CO., LTD. (TH) 2021-09-23 — — WO disclosed
US-10231624-B2 Intra-operative head and neck nerve mapping NOV ADAQ TECHNOLOGIES ULC (CA) 2019-03-19 — — US disclosed
US-20180153984-A1 ADJUVANT PARTICLES COMPRISING ADENOSINE RECEPTOR ANTAGONISTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-06-07 — — US disclosed
US-8357675-B2 17-alpha-substituted derivatives of estradiol with wound-healing activity EUTICALS S.P.A. (IT) 2013-01-22 — — US disclosed
EP-1910398-B1 17-ALPHA-SUBSTITUTED DERIVATIVES OF ESTRADIOL WITH WOUND-HEALING ACTIVITY PRIME EUROP THERAPEUTICALS (IT) 2010-11-24 — — EP disclosed
US-20100222673-A1 INTRA-OPERATIVE HEAD AND NECK NERVE MAPPING NOVADAQ TECHNOLOGIES INC. (CA) 2010-09-02 — — US disclosed
US-20100035796-A1 17-ALPHA-SUBSTITUTED DERIVATIVES OF ESTRADIOL WITH WOUND-HEALING ACTIVITY EUTICALS S.P.A. (IT) 2010-02-11 — — US disclosed
WO-2007016790-A1 INTRA-OPERATIVE HEAD & NECK NERVE MAPPING NOVADAQ TECHNOLOGIES, INC. (CA) 2007-02-15 — — WO disclosed
EP-0348497-A1 NON-LINEAR OPTICAL MATERIAL CONTAINING A HEMICYANINE COMPOUND AND PROCESS FOR PRODUCING IT MERCK PATENT GmbH (DE) 1990-01-03 — — EP disclosed
WO-1989005843-A1 NON-LINEAR OPTICAL MATERIAL CONTAINING A HEMICYANINE COMPOUND AND PROCESS FOR PRODUCING IT MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-06-29 — — 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 (2 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-20230181744-A1 COMPOUND FOR PREVENTING OR TREATING LIPID METABOLISM-RELATED DISEASES MAP1LC3B, MAP1LC3A, SQSTM1 CHRM2 3349/4885CHRM4 3130/4885CHRM5 4169/4885
US-20100035796-A1 17-ALPHA-SUBSTITUTED DERIVATIVES OF ESTRADIOL WITH WOUND-HEALING ACTIVITY HSD17B11, CYP19A1, ESR1 CHRM2 848/4885CHRM4 1406/4885CHRM5 443/4885

“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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