SCHEMBL12682333

SCHEMBL12682333

Oc1ccc(-c2cn(-c3ccc(O)c(O)c3)nn2)cc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 2/20 1.00
▸ MAPT P10636 1/20 1.00
▸ HSD17B1 P14061 2/20 0.55
▸ HSD17B2 P37059 2/20 0.55
▸ CA1 P00915 5/20 0.49
▸ CA2 P00918 5/20 0.49
▸ CA5A P35218 5/20 0.49
▸ CA5B Q9Y2D0 5/20 0.49
▸ FLT3 P36888 4/20 0.47
▸ ESRRG P62508 1/20 0.46
▸ MIF P14174 1/20 0.46
▸ NME4 O00746 1/20 0.46
▸ GCDH Q92947 1/20 0.46
▸ SIRT5 Q9NXA8 1/20 0.46
▸ CYP1B1 Q16678 1/20 0.44
▸ PTGS2 P35354 3/20 0.43
▸ KEAP1 Q14145 1/20 0.43
▸ NFE2L2 Q16236 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA9 Q16790 1/20 0.43

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
SCHEMBL23405482 0.91 MAPT (0.83) SNCAMAPTHSD17B1HSD17B2CA1
SCHEMBL23405495 0.90 MAPT (0.82) SNCAMAPTHSD17B1HSD17B2CA1
SCHEMBL23405476 0.90 MAPT (0.81) SNCAMAPTHSD17B1HSD17B2CA1
SCHEMBL23405494 0.90 MAPT (0.81) SNCAMAPTHSD17B1HSD17B2CA1
SCHEMBL23405479 0.88 MAPT (0.78) SNCAMAPTHSD17B1HSD17B2CA1
SCHEMBL23405496 0.88 MAPT (0.78) SNCAMAPTHSD17B1HSD17B2CA1
SCHEMBL23405489 0.88 MAPT (0.78) SNCAMAPTHSD17B1HSD17B2CA1
SCHEMBL23430997 0.87 MAPT (0.77) SNCAMAPTHSD17B1HSD17B2CA1
SCHEMBL23405505 0.84 MAPT (0.72) SNCAMAPTHSD17B1HSD17B2CA1
SCHEMBL23430953 0.84 MAPT (0.72) SNCAMAPTHSD17B1HSD17B2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180002298-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PROTAMED INC (US) 2018-01-04 — — US disclosed
US-20170022174-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PROTAMED INC (US) 2017-01-26 — — US disclosed
US-20170022174-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PROTAMED INC (US) 2017-01-26 — — US disclosed
US-9334251-B2 Compounds for the treatment of neurodegenerative diseases PROTAMED, INC. (US) 2016-05-10 — — US disclosed
US-9334251-B2 Compounds for the treatment of neurodegenerative diseases PROTAMED, INC. (US) 2016-05-10 — — US disclosed
US-20150274681-A1 Compounds for the treatment of Neurodegenerative Diseases PROTEOTECH INC. (US) 2015-10-01 — — US disclosed
US-20150274681-A1 Compounds for the treatment of Neurodegenerative Diseases PROTEOTECH INC. (US) 2015-10-01 — — US disclosed
US-9085549-B2 Compounds for the treatment of neurodegenerative diseases PROTEOTECH INC (US) 2015-07-21 — — US disclosed
US-9085549-B2 Compounds for the treatment of neurodegenerative diseases PROTEOTECH INC (US) 2015-07-21 — — US disclosed
US-20150011604-A1 Compounds for the treatment of neurodegenerative diseases PROTEOTECH INC. (US) 2015-01-08 — — US disclosed
US-20150011604-A1 Compounds for the treatment of neurodegenerative diseases PROTEOTECH INC. (US) 2015-01-08 — — US disclosed
US-8865754-B2 Compounds for the treatment of neurodegenerative diseases PROTEOTECH INC. (US) 2014-10-21 — — US disclosed
US-8865754-B2 Compounds for the treatment of neurodegenerative diseases PROTEOTECH INC. (US) 2014-10-21 — — US disclosed
US-20120251448-A1 Compounds for Use in the Detection of Neurodegenerative Diseases AVID RADIOPHARMACEUTICALS, INC. 2012-10-04 — — US disclosed
US-20120251448-A1 Compounds for Use in the Detection of Neurodegenerative Diseases AVID RADIOPHARMACEUTICALS, INC. 2012-10-04 — — US disclosed
WO-2012118935-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PROTEOTECH INC (US) 2012-09-07 — — 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 (5 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-20150274681-A1 Compounds for the treatment of Neurodegenerative Diseases PSEN1, PSEN2, GRN SNCA 18/4885MAPT 4/4885HSD17B1 1374/4885
US-20180002298-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PSEN1, PSEN2, GRN SNCA 18/4885MAPT 4/4885HSD17B1 1374/4885
US-20150011604-A1 Compounds for the treatment of neurodegenerative diseases SNCA, MAPT, PARK7 SNCA 1/4885MAPT 2/4885HSD17B1 3806/4885
US-20120251448-A1 Compounds for Use in the Detection of Neurodegenerative Diseases SNCA, PARK7, NLN SNCA 1/4885MAPT 15/4885HSD17B1 4489/4885
US-20170022174-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PSEN1, PSEN2, GRN SNCA 18/4885MAPT 4/4885HSD17B1 1374/4885

“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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