SCHEMBL16181212

SCHEMBL16181212

COc1cc(C(=O)/C=C/c2cc(OC)c(OC)cc2Br)ccc1C

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 5/20 0.59
▸ SNCA P37840 2/20 0.54
▸ KDM1A O60341 1/20 0.54
▸ ABCB1 P08183 2/20 0.53
▸ PTPN1 P18031 3/20 0.52
▸ DPP4 P27487 3/20 0.52
▸ TNFRSF1A P19438 5/20 0.51
▸ MAPT P10636 2/20 0.50
▸ CYP1A1 P04798 1/20 0.49
▸ CYP1B1 Q16678 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ ATM Q13315 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL16181498 0.91 ABCG2 (0.67) ABCG2SNCAKDM1AABCB1PTPN1
SCHEMBL16181228 0.78 ABCG2 (0.86) ABCG2ABCB1TNFRSF1AMAPTCYP1A1
SCHEMBL15807343 0.77 TNFRSF1A (0.79) ABCG2ABCB1TNFRSF1AMAPTCYP1A1
SCHEMBL30928257 0.77 NFE2L2 (0.71) ABCG2SNCAKDM1ATNFRSF1AMAPT
SCHEMBL8977123 0.76 ABCG2 (0.69) ABCG2TNFRSF1AMAPTMEN1LMNA
SCHEMBL8977121 0.76 ABCG2 (0.69) ABCG2TNFRSF1AMAPTMEN1LMNA
SCHEMBL25302141 0.76 ABCG2 (0.74) ABCG2ABCB1TNFRSF1AMAPTMEN1
SCHEMBL16211003 0.76 TNFRSF1A (0.78) ABCG2ABCB1DPP4TNFRSF1AMAPT
SCHEMBL16211002 0.76 TNFRSF1A (0.78) ABCG2ABCB1DPP4TNFRSF1AMAPT
SCHEMBL30307308 0.76 TNFRSF1A (0.78) ABCG2ABCB1DPP4TNFRSF1AMAPT

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 7 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-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-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-8865754-B2 Compounds for the treatment of neurodegenerative diseases PROTEOTECH INC. (US) 2014-10-21 — — US 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-20150274681-A1 Compounds for the treatment of Neurodegenerative Diseases PSEN1, PSEN2, GRN ABCG2 3674/4885SNCA 18/4885KDM1A 2816/4885
US-20180002298-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PSEN1, PSEN2, GRN ABCG2 3674/4885SNCA 18/4885KDM1A 2816/4885
US-20150011604-A1 Compounds for the treatment of neurodegenerative diseases SNCA, MAPT, PARK7 ABCG2 1711/4885SNCA 1/4885KDM1A 4306/4885
US-20170022174-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PSEN1, PSEN2, GRN ABCG2 3674/4885SNCA 18/4885KDM1A 2816/4885

“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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