SCHEMBL61984

SCHEMBL61984

[O-][n+]1[c]ncc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.41
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
ACHE P22303 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL449126 0.70 ATM (0.46) ATMALDH1A1GLAMAPTHPGD
SCHEMBL24772 0.67 ATM (0.43) ATMACHENPC1RAB9A
SCHEMBL51544 0.65 ATM (0.41) ATMNPC1RAB9A
SCHEMBL253244 0.65 ATM (0.41) ATMACHENPC1RAB9A
SCHEMBL51581 0.65 ATM (0.41) ATMNPC1RAB9A
Hydrochloric Acid SCHEMBL10501335 0.64 ATM (0.40) ATMACHENPC1RAB9A
SCHEMBL9477126 0.63 ATM (0.48) ATMALDH1A1MAPTNPC1RAB9A
SCHEMBL8424490 0.63 ATM (0.48) ATMNPC1RAB9A
SCHEMBL4559941 0.63 ATM (0.48) ATMNPC1RAB9A
SCHEMBL3535166 0.63 ATM (0.48) ATMMAPTNPC1RAB9A

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 1301 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3160517-B1 WATER-SOLUBLE ACTIVATABLE MOLECULAR PROBES, INTERMEDIATES FOR THE SYNTHESIS THEREOF AND ASSOCIATED DETECTION METHODS ECOLE NORMALE SUPERIEURE LYON (FR) 2024-06-12 EP claimed
EP-3555112-B1 FLUOROGENIC GLYCOSIDASE SUBSTRATE AND ASSOCIATED DETECTION METHOD ECOLE NORMALE SUPERIEURE LYON (FR) 2023-12-06 EP claimed
EP-3555112-A1 FLUOROGENIC GLYCOSIDASE SUBSTRATE AND ASSOCIATED DETECTION METHOD Ecole Normale Superieure De Lyon (FR) 2019-10-23 EP claimed
US-10179929-B2 Water-soluble activatable molecular probes, intermediates for the synthesis thereof and associated detection methods ECOLE NORMALE SUPERIEURE DE LYON (FR) 2019-01-15 US claimed
EP-2760844-B1 FLUOROGENIC PEPTIDASE SUBSTRATE ECOLE NORMALE SUPERIEURE LYON (FR) 2018-11-21 EP claimed
US-20170159100-A1 WATER-SOLUBLE ACTIVATABLE MOLECULAR PROBES, INTERMEDIATES FOR THE SYNTHESIS THEREOF AND ASSOCIATED DETECTION METHODS ECOLE NORMALE SUPERIEURE DE LYON (FR) 2017-06-08 US claimed
US-9605296-B2 Fluorogenic peptidase substrate ECOLE NORMALE SUPERIEURE DE LYON (FR) 2017-03-28 US claimed
US-9593362-B2 Fluorogenic glycosidase substrate and associated detection method ECOLE NORMALE SUPERIEURE DE LYON (FR) 2017-03-14 US claimed
EP-2880045-B1 FLUOROGENIC GLYCOSIDASE SUBSTRATE AND ASSOCIATED DETECTION PROCESS Ecole Normale Supérieure de Lyon (FR) 2016-07-20 EP claimed
US-20150299762-A1 FLUOROGENIC GLYCOSIDASE SUBSTRATE AND ASSOCIATED DETECTION METHOD ECOLE NORMALE SUPERIEURE DE LYON (FR) 2015-10-22 US claimed
EP-0700904-B1 Heterocyclic-N-oxide substituted benzoylguanidines, process for their preparation, their use as medicament or diagnostic as well as medicaments containing them HOECHST AG (DE) 2001-12-05 EP claimed
EP-0794955-B1 HINDERED N-OXIDE ESTERS OF RAPAMYCIN AND THEIR USE AS MEDICAMENTS AMERICAN HOME PROD (US) 2001-07-25 EP claimed
US-5559122-A Hindered N-oxide esters of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1996-09-24 US claimed
US-5521194-A Hindered N-oxide esters of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1996-05-28 US claimed
US-5508290-A Hindered N-oxide esters of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1996-04-16 US claimed
US-5508285-A Hindered N-oxide esters of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1996-04-16 US claimed
US-5491231-A Hindered N-oxide esters of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1996-02-13 US claimed
EP-0584222-A4 BIS MONO-AND BICYCLIC ARYL AND HETEROARYL COMPOUNDS WHICH INHIBIT EGF AND/OR PDGF RECEPTOR TYROSINE KINASE RHONE POULENC RORER INT (US) 1994-07-06 EP claimed
EP-0584222-A1 BIS MONO-AND BICYCLIC ARYL AND HETEROARYL COMPOUNDS WHICH INHIBIT EGF AND/OR PDGF RECEPTOR TYROSINE KINASE. RHONE POULENC RORER INT (US) 1994-03-02 EP claimed
WO-1992020642-A1 BIS MONO-AND BICYCLIC ARYL AND HETEROARYL COMPOUNDS WHICH INHIBIT EGF AND/OR PDGF RECEPTOR TYROSINE KINASE RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-11-26 WO claimed

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-10179929-B2 Water-soluble activatable molecular probes, intermediates for the synthesis thereof and associated detection methods SI, GUSB, ABCG2 ATM 4251/4885ALDH1A1 426/4885GLA 51/4885
US-20170159100-A1 WATER-SOLUBLE ACTIVATABLE MOLECULAR PROBES, INTERMEDIATES FOR THE SYNTHESIS THEREOF AND ASSOCIATED DETECTION METHODS SI, GUSB, ABCG2 ATM 4251/4885ALDH1A1 426/4885GLA 51/4885
US-20150299762-A1 FLUOROGENIC GLYCOSIDASE SUBSTRATE AND ASSOCIATED DETECTION METHOD MAN2B1, FUCA1, NEU1 ATM 4875/4885ALDH1A1 200/4885GLA 31/4885

“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.