SCHEMBL13400736

SCHEMBL13400736

Cc1cc(C(C)(C)C)sc1C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.32
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.30
PRKDC P78527 1/20 0.30
ERCC5 P28715 1/20 0.30
FEN1 P39748 1/20 0.30

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
SCHEMBL26710124 0.84
SCHEMBL10123652 0.77 KDM4E (0.38) PDPK1POLBKMT2APRKDCERCC5
SCHEMBL12163686 0.77 POLB (0.32) POLBKMT2A
SCHEMBL6897304 0.75 ALDH1A1 (0.40) PDPK1POLBPRKDCERCC5FEN1
SCHEMBL21721183 0.73 POLB (0.30) POLB
SCHEMBL21718670 0.73 POLB (0.30) POLB
SCHEMBL10058091 0.73 DAO (0.42) PDPK1POLB
SCHEMBL21721618 0.73 PDPK1 (0.31) PDPK1POLB
SCHEMBL21720008 0.73 PDPK1 (0.31) PDPK1POLB
SCHEMBL17369206 0.73 PDPK1 (0.31) PDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240204199-A1 Electrode Having Improved Safety and Method of Manufacturing the Same LG ENERGY SOLUTION, LTD. (KR) 2024-06-20 US disclosed
WO-2024085668-A1 CURRENT COLLECTOR 주식회사 엘지화학 2024-04-25 WO disclosed
US-20230287272-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DEVICE DIC CORPORATION (JP) 2023-09-14 US disclosed
US-20220213131-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-07-07 US disclosed
US-20220165967-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-05-26 US disclosed
US-11114251-B2 Polymer, method for preparing the same and solar cell comprising the polymer BOE TECHNOLOGY GROUP CO., LTD. (CN) 2021-09-07 US disclosed
US-9908979-B2 Polythiophene star copolymer capable of being self-doped by external stimulus, a method for producing the same, a conductive thin film using the same, and a method for producing the conductive thin film KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2018-03-06 US disclosed
EP-2635524-B1 METHOD OF SELECTIVE SEPARATION OF SEMICONDUCTING CARBON NANOTUBES SAMSUNG ELECTRONICS CO LTD (KR) 2017-08-23 EP disclosed
US-20150376172-A1 FLUORO-[1,3]OXAZINES AS BACE1 INHIBITORS WOLTERING THOMAS (US) 2015-12-31 US disclosed
US-7691493-B2 Polymeric compound and organic luminescence device CANON KABUSHIKI KAISHA (JP) 2010-04-06 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 (3 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-20150376172-A1 FLUORO-[1,3]OXAZINES AS BACE1 INHIBITORS BACE1, BACE2, PSEN1 PDPK1 755/4885POLB 888/4885KMT2A 2329/4885
US-20220165967-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, ICOSLG PDPK1 3151/4885POLB 2786/4885KMT2A 3090/4885
US-20220213131-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, LOXL1, OCIAD2 PDPK1 3827/4885POLB 1993/4885KMT2A 4084/4885

“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.