SCHEMBL1818067

SCHEMBL1818067

BrCCCCCCCCC1(CCCCCCCCBr)c2cc(Br)ccc2-c2ccc(Br)cc21

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.36
AKR1A1 P14550 1/20 0.32
AKR1B1 P15121 1/20 0.32
S100A4 P26447 1/20 0.31
TDP2 O95551 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 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
SCHEMBL31125229 1.00 PDK2 (0.36) PDK2AKR1A1AKR1B1S100A4TDP2
SCHEMBL32680096 1.00 PDK2 (0.36) PDK2AKR1A1AKR1B1S100A4TDP2
SCHEMBL29386996 1.00 PDK2 (0.36) PDK2AKR1A1AKR1B1S100A4TDP2
SCHEMBL30433641 1.00 PDK2 (0.36) PDK2AKR1A1AKR1B1S100A4TDP2
SCHEMBL40737 1.00 PDK2 (0.36) PDK2AKR1A1AKR1B1S100A4TDP2
SCHEMBL25491614 1.00 PDK2 (0.36) PDK2AKR1A1AKR1B1S100A4TDP2
SCHEMBL3851000 1.00 PDK2 (0.36) PDK2AKR1A1AKR1B1S100A4TDP2
SCHEMBL2589743 0.93 PDK2 (0.38) PDK2AKR1A1AKR1B1S100A4TDP2
SCHEMBL30394000 0.93 PDK2 (0.38) PDK2AKR1A1AKR1B1S100A4TDP2
SCHEMBL15124484 0.92 PDK2 (0.32) PDK2TDP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159457-A1 FLUORENE DERIVATIVES, POLYMERS OBTAINED FROM SAID FLUORENE DERIVATIVES AND METHOD FOR PREPARING THE SAME IRPC PUBLIC COMPANY LIMITED (TH) 2023-05-25 US disclosed
US-20220025111-A1 NARROW ABSORPTION POLYMER NANOPARTICLES AND RELATED METHODS UNIVERSITY OF WASHINGTON (US) 2022-01-27 US disclosed
EP-3853590-A1 NARROW ABSORPTION POLYMER NANOPARTICLES AND RELATED METHODS University of Washington (US) 2021-07-28 EP disclosed
WO-2020060937-A1 NARROW ABSORPTION POLYMER NANOPARTICLES AND RELATED METHODS UNIVERSITY OF WASHINGTON (US) 2020-03-26 WO disclosed
US-9419224-B2 Fluoro group-containing compound, fluoro group-containing polymer, organic light emitting device including the polymer, and method of manufacturing the device SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-08-16 US disclosed
US-9419224-B2 Fluoro group-containing compound, fluoro group-containing polymer, organic light emitting device including the polymer, and method of manufacturing the device SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-08-16 US disclosed
US-20110121338-A1 FLUORO GROUP-CONTAINING COMPOUND, FLUORO GROUP-CONTAINING POLYMER, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE POLYMER, AND METHOD OF MANUFACTURING THE DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-05-26 US disclosed
US-20110121338-A1 FLUORO GROUP-CONTAINING COMPOUND, FLUORO GROUP-CONTAINING POLYMER, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE POLYMER, AND METHOD OF MANUFACTURING THE DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-05-26 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-20110121338-A1 FLUORO GROUP-CONTAINING COMPOUND, FLUORO GROUP-CONTAINING POLYMER, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE POLYMER, AND METHOD OF MANUFACTURING THE DEVICE PFAS, AFF1, AFF4 PDK2 4527/4885AKR1A1 3597/4885AKR1B1 3421/4885
US-20230159457-A1 FLUORENE DERIVATIVES, POLYMERS OBTAINED FROM SAID FLUORENE DERIVATIVES AND METHOD FOR PREPARING THE SAME TERT, F12, F3 PDK2 2596/4885AKR1A1 2952/4885AKR1B1 2884/4885

“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.