SCHEMBL18242536

SCHEMBL18242536

CC[CH]c1cccc(CC)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
MGLL Q99685 1/20 0.40
HDAC4 P56524 1/20 0.40
MEF2D Q14814 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2A6 P11509 1/20 0.40
BCL2 P10415 1/20 0.38
RAPGEF4 Q8WZA2 1/20 0.38
IDO1 P14902 1/20 0.37
TRPA1 O75762 1/20 0.37
KIF11 P52732 2/20 0.36
NISCH Q9Y2I1 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL18242054 0.87 TP53 (0.41) TP53MGLLHDAC4MEF2DCYP1A2
SCHEMBL291613 0.84 MAOA (0.49) TP53MGLLHDAC4MEF2DCYP1A2
SCHEMBL5250814 0.84 TP53 (0.46) TP53MGLLHDAC4MEF2DCYP1A2
SCHEMBL2187122 0.83 ALDH1A1 (0.37) TP53CYP2A6ALDH1A1SMN1; SMN2NPC1
SCHEMBL18243406 0.83 CNR1 (0.39) HDAC4MEF2DKIF11
SCHEMBL9306879 0.82 LPL (0.38) TP53MGLLHDAC4MEF2DCYP1A2
SCHEMBL1003365 0.82 TP53 (0.44) TP53MGLLHDAC4MEF2DCYP1A2
SCHEMBL16167528 0.81 HDAC4 (0.43) TP53MGLLHDAC4MEF2DCYP1A2
SCHEMBL16167524 0.81 HDAC4 (0.43) TP53MGLLHDAC4MEF2DCYP1A2
SCHEMBL318201 0.80 HDAC4 (0.49) TP53HDAC4MEF2DMAOAMAOB

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
EP-3583211-B1 METHOD FOR THE SYNTHESIS OF DNA CONJUGATES BY MICELLAR CATALYSIS UNIV DORTMUND TECH (DE) 2024-04-10 EP disclosed
CN-110300804-B Method for synthesizing DNA conjugate by micelle catalysis 多特蒙德工业大学 2024-02-02 CN disclosed
US-20220002712-A1 METHOD FOR THE SYNTHESIS OF DNA CONJUGATES BY MICELLAR CATALYSIS TECHNISCHE UNIVERSITÄT DORTMUND (DE) 2022-01-06 US disclosed
US-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-22 US disclosed
WO-2018149863-A1 METHOD FOR THE SYNTHESIS OF DNA CONJUGATES BY MICELLAR CATALYSIS TECHNISCHE UNIVERSITÄT DORTMUND (DE) 2018-08-23 WO disclosed
CN-105873691-B Cleaning formulation for removing residues on surfaces 富士胶片电子材料美国有限公司 2018-04-20 CN disclosed
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2016-11-24 US disclosed
CN-105873691-A Cleaning formulation for removing residues on surfaces 富士胶片电子材料美国有限公司 2016-08-17 CN 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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical CBR1, HAO2, CBR3 TP53 4315/4885MGLL 2557/4885HDAC4 3751/4885
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL CBR1, HAO2, CBR3 TP53 4315/4885MGLL 2557/4885HDAC4 3751/4885

“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.