SCHEMBL13311374

SCHEMBL13311374

CC/N=c1/cc2oc3cc(NCC)c(C)cc3c(-c3ccccc3C(=O)OC)c-2cc1C

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.44
▸ USP2 O75604 2/20 0.43
▸ ATM Q13315 2/20 0.43
▸ CFTR P13569 1/20 0.43
▸ PAX8 Q06710 1/20 0.43
▸ GOPC Q9HD26 1/20 0.43
▸ KDM4E B2RXH2 7/20 0.34
▸ ALDH1A1 P00352 5/20 0.34
▸ MAPT P10636 4/20 0.34
▸ GAA P10253 3/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ POLB P06746 3/20 0.34
▸ FTO Q9C0B1 2/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ BLM P54132 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34

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
Hydrochloric Acid SCHEMBL29460430 0.99 USP2 (0.44) ABCB1USP2ATMCFTRPAX8
Rhodamine 6G SCHEMBL4817749 0.94 ABCB1 (0.38) ABCB1USP2ATMCFTRPAX8
Rhodamine 6G SCHEMBL1495836 0.94 ABCB1 (0.38) ABCB1USP2ATMCFTRPAX8
Rhodamine 6G SCHEMBL10028465 0.94 ABCB1 (0.38) ABCB1USP2ATMCFTRPAX8
Rhodamine 6G SCHEMBL23064835 0.93 USP2 (0.38) ABCB1USP2ATMCFTRPAX8
Rhodamine 6G SCHEMBL5403477 0.93 USP2 (0.38) ABCB1USP2ATMCFTRPAX8
Rhodamine 6G SCHEMBL58076 0.93 USP2 (0.38) ABCB1USP2ATMCFTRPAX8
Rhodamine 6G SCHEMBL5606069 0.93 USP2 (0.38) ABCB1USP2ATMCFTRPAX8
Rhodamine 6G SCHEMBL23064834 0.93 USP2 (0.38) ABCB1USP2ATMCFTRPAX8
Rhodamine 6G SCHEMBL15348373 0.93 USP2 (0.38) ABCB1USP2ATMCFTRPAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130203843-A1 MILD CATIONIC MITOCHONDRIAL UNCOUPLERS LIMITED LIABILITY COMPANY MITOTECH 2013-08-08 — — US disclosed
US-20100159383-A1 METHOD FOR PRODUCING COLOR PRINT KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2010-06-24 — — 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 (1 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-20130203843-A1 MILD CATIONIC MITOCHONDRIAL UNCOUPLERS MCU, ARG2, TFAM ABCB1 2415/4885USP2 4550/4885ATM 4573/4885

“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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