SCHEMBL16079453

SCHEMBL16079453

Cc1c2nc3ccccc3sc-2c(C)c(=O)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDAH1 O94760 1/20 0.41
▸ NPC1 O15118 7/20 0.40
▸ RAB9A P51151 7/20 0.40
▸ SMN1; SMN2 Q16637 6/20 0.40
▸ PSMB8 P28062 1/20 0.40
▸ PSMB5 P28074 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ ADORA1 P30542 1/20 0.40
▸ DYRK1A Q13627 1/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ FBP1 P09467 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ ADRA2B P18089 1/20 0.40
▸ ADRA2C P18825 1/20 0.40
▸ DRD1 P21728 1/20 0.40
▸ MC5R P33032 1/20 0.40

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
SCHEMBL10500123 0.84 KAT2A (0.41) DDAH1NPC1RAB9ASMN1; SMN2PSMB8
SCHEMBL16071123 0.81 RAB9A (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1TDP1
SCHEMBL16071120 0.81 DYRK1A (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1TDP1
SCHEMBL9813146 0.81 SMN1; SMN2 (0.46) NPC1RAB9ASMN1; SMN2ALDH1A1TDP1
SCHEMBL16061812 0.78 NPC1 (0.40) DDAH1NPC1RAB9ASMN1; SMN2PSMB8
SCHEMBL16071169 0.77 APP (0.45) SMN1; SMN2ALDH1A1TDP1HPGDALOX15
SCHEMBL16071168 0.77 APP (0.39) NPC1RAB9ASMN1; SMN2PSMB5ALDH1A1
SCHEMBL10592292 0.77 MAPT (0.40) DDAH1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL16071170 0.76 EPHX2 (0.50) DYRK1AKDM4E
SCHEMBL16071126 0.76 DYRK1A (0.48) DYRK1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9868711-B2 Phenazine-3-one and phenothiazine-3-one derivatives for treatment of oxidative stress disorders BIOELECTRON TECHNOLOGY CORPORATION (US) 2018-01-16 — — US disclosed
US-9868711-B2 Phenazine-3-one and phenothiazine-3-one derivatives for treatment of oxidative stress disorders BIOELECTRON TECHNOLOGY CORPORATION (US) 2018-01-16 — — US disclosed
US-20160039776-A1 PHENAZINE-3-ONE AND PHENOTHIAZINE-3-ONE DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISORDERS PTC THERAPEUTICS, INC. 2016-02-11 — — US disclosed
US-20140275045-A1 PHENAZINE-3-ONE AND PHENOTHIAZINE-3-ONE DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISORDERS EDISON PHARMACEUTICALS, INC. (US) 2014-09-18 — — 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 (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-20140275045-A1 PHENAZINE-3-ONE AND PHENOTHIAZINE-3-ONE DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISORDERS PCK2, MGST3, TXNRD2 DDAH1 3965/4885NPC1 901/4885RAB9A 3377/4885
US-20160039776-A1 PHENAZINE-3-ONE AND PHENOTHIAZINE-3-ONE DERIVATIVES FOR TREATMENT OF OXIDATIVE STRESS DISORDERS PCK2, MGST3, TXNRD2 DDAH1 3965/4885NPC1 901/4885RAB9A 3377/4885

“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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